Vitas-M small molecule compound
4-[5-(4-fluorophenyl)-2-(3-nitrophenyl)-4,6-dioxohexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl benzoate
Catalog ID
STL042752
SMILES Fc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)OC(=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 C30H20FN3O7 MW 553.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H20FN3O7/c31-20-11-13-21(14-12-20)32-28(35)25-26(18-9-15-24(16-10-18)40-30(37)19-5-2-1-3-6-19)33(41-27(25)29(32)36)22-7-4-8-23(17-22)34(38)39/h1-17,25-27HInChIKey
NZYFSQLOPMUSLX-UHFFFAOYSA-NSynonyms
(4(5(4FLUOROPHENYL)2(3NITROPHENYL)46DIOXO3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZOATE
4(5(4fluorophenyl)2(3nitrophenyl)46dioxohexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzoate
4(5(4fluorophenyl)2(3nitrophenyl)46dioxohexahydro2Hpyrrolo(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)F)ON3C6=CC(=CC=C6)(N+)(=O)(O)
Fc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)OC(=O)c1ccccc1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC30H20FN3O7c3120111321(141220)3228(35)2526(1891524(161018)4030(37)195213619)33(4127(25)29(32)36)2274823(1722)34(38)39h1172527H
MFCD04170325
ZINC000102871708
ZINC000106015294
Check stock
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Check stock on Vitas-MAvailable files
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