Vitas-M small molecule compound
4-[5-(4-nitrophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl benzoate
Catalog ID
STL041029
SMILES O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C(c1ccc(cc1)OC(=O)c1ccccc1)N(O2)c1ccccc1
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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 C30H21N3O7 MW 535.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21N3O7/c34-28-25-26(19-11-17-24(18-12-19)39-30(36)20-7-3-1-4-8-20)32(22-9-5-2-6-10-22)40-27(25)29(35)31(28)21-13-15-23(16-14-21)33(37)38/h1-18,25-27HInChIKey
CULCPBQILUMGDD-UHFFFAOYSA-NSynonyms
1024274-14-3(4(5(4NITROPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZOATE
1024274143
4(5(4nitrophenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzoate
4(5(4nitrophenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenylbenzoate
C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)C5=CC=C(C=C5)(N+)(=O)(O))ON3C6=CC=CC=C6
InChI=1SC30H21N3O7c34282526(19111724(181219)3930(36)207314820)32(2295261022)4027(25)29(35)31(28)21131523(161421)33(37)38h1182527H
MFCD04186189
O=C1N(c2ccc(cc2)(N+)(=O)(O))C(=O)C2C1C(c1ccc(cc1)OC(=O)c1ccccc1)N(O2)c1ccccc1
ZINC000097954682
ZINC000102753994
Check stock
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Check stock on Vitas-MAvailable files
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