Vitas-M small molecule compound
4-[2-(3-nitrophenyl)-4,6-dioxo-5-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl benzoate
Catalog ID
STL056253
SMILES O=C(c1ccccc1)Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccccc1)c1cccc(c1)[N+](=O)[O-]
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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(19-14-16-24(17-15-19)39-30(36)20-8-3-1-4-9-20)32(22-12-7-13-23(18-22)33(37)38)40-27(25)29(35)31(28)21-10-5-2-6-11-21/h1-18,25-27HInChIKey
KGBLZUFTTAWBDC-UHFFFAOYSA-NSynonyms
1023849-63-9(4(2(3NITROPHENYL)46DIOXO5PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZOATE
1023849639
4(2(3nitrophenyl)46dioxo5phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzoate
4(2(3nitrophenyl)46dioxo5phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenylbenzoate
C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)C5=CC=CC=C5)ON3C6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC30H21N3O7c34282526(19141624(171519)3930(36)208314920)32(221271323(1822)33(37)38)4027(25)29(35)31(28)21105261121h1182527H
MFCD04191155
O=C(c1ccccc1)Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccccc1)c1cccc(c1)(N+)(=O)(O)
ZINC000097954747
ZINC000227244103
Check stock
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Check stock on Vitas-MAvailable files
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