[2-oxidanylidene-2-(2-phenylethanoylamino)ethyl] (2R)-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylethanoylamino)ethyl] (2R)-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-oxo-2-[(2-phenylacetyl)amino]ethyl] (2R)-2-[(4-chloro-3-nitro-benzoyl)amino]-3-methyl-butanoate CAS Name: (2R)-2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-oxo-2-[(1-oxo-2-phenylethyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(2-phenylacetyl)amino]ethyl] (2R)-2-[(4-chloro-3-nitrobenzoyl)amino]-3-methylbutanoate Traditional Name: (2R)-2-[(4-chloro-3-nitro-benzoyl)amino]-3-methyl-butyric acid [2-keto-2-[(2-phenylacetyl)amino]ethyl] ester Formula: C22H22ClN3O7 MolecularWeight: 475.87898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC(=O)CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NC(=O)CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H22ClN3O7/c1-13(2)20(25-21(29)15-8-9-16(23)17(11-15)26(31)32)22(30)33-12-19(28)24-18(27)10-14-6-4-3-5-7-14/h3-9,11,13,20H,10,12H2,1-2H3,(H,25,29)(H,24,27,28)/t20-/m1/s1