methyl 2-[[2-methyl-2-[methyl-(4-nitrophenyl)carbonyl-amino]propanoyl]amino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[[2-methyl-2-[methyl-(4-nitrophenyl)carbonyl-amino]propanoyl]amino]-2-phenyl-ethanoate Openeye Name: methyl 2-[[2-methyl-2-[methyl-(4-nitrobenzoyl)amino]propanoyl]amino]-2-phenyl-acetate CAS Name: 2-[[2-methyl-2-[methyl-[(4-nitrophenyl)-oxomethyl]amino]-1-oxopropyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[[2-methyl-2-[methyl-(4-nitrobenzoyl)amino]propanoyl]amino]-2-phenylacetate Traditional Name: 2-[[2-methyl-2-[methyl-(4-nitrobenzoyl)amino]propanoyl]amino]-2-phenyl-acetic acid methyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(C1=CC=CC=C1)C(=O)OC)N(C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C(=O)NC(C1=CC=CC=C1)C(=O)OC)N(C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6/c1-21(2,23(3)18(25)15-10-12-16(13-11-15)24(28)29)20(27)22-17(19(26)30-4)14-8-6-5-7-9-14/h5-13,17H,1-4H3,(H,22,27)