Vitas-M small molecule compound
2-methoxy-4-[2-(3-nitrophenyl)-4,6-dioxo-5-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl benzoate
Catalog ID
STL055948
SMILES COc1cc(ccc1OC(=O)c1ccccc1)C1N(OC2C1C(=O)N(C2=O)c1ccccc1)c1cccc(c1)[N+](=O)[O-]
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C31H23N3O8 MW 565.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23N3O8/c1-40-25-17-20(15-16-24(25)41-31(37)19-9-4-2-5-10-19)27-26-28(30(36)32(29(26)35)21-11-6-3-7-12-21)42-33(27)22-13-8-14-23(18-22)34(38)39/h2-18,26-28H,1H3InChIKey
JJWRMUDJDIYGKZ-UHFFFAOYSA-NSynonyms
(2METHOXY4(2(3NITROPHENYL)46DIOXO5PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZOATE
2methoxy4(2(3nitrophenyl)46dioxo5phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzoate
2methoxy4(2(3nitrophenyl)46dioxo5phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenylbenzoate
COC1=C(C=CC(=C1)C2C3C(C(=O)N(C3=O)C4=CC=CC=C4)ON2C5=CC(=CC=C5)(N+)(=O)(O))OC(=O)C6=CC=CC=C6
COc1cc(ccc1OC(=O)c1ccccc1)C1N(OC2C1C(=O)N(C2=O)c1ccccc1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC31H23N3O8c140251720(151624(25)4131(37)1994251019)272628(30(36)32(29(26)35)21116371221)4233(27)221381423(1822)34(38)39h2182628H1H3
MFCD05737714
ZINC000102895217
ZINC000227243603
Check stock
See real-time availability and sample size for STL055948 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.