2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-methyl-N-(4-nitrophenyl)butanamide

Systemtic Name: 2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-methyl-N-(4-nitrophenyl)butanamide Openeye Name: 2-[(2-amino-3-phenyl-propanoyl)amino]-3-methyl-N-(4-nitrophenyl)butanamide CAS Name: 2-[(2-amino-1-oxo-3-phenylpropyl)amino]-3-methyl-N-(4-nitrophenyl)butanamide IUPAC Name: 2-[(2-amino-3-phenylpropanoyl)amino]-3-methyl-N-(4-nitrophenyl)butanamide Traditional Name: 3-methyl-N-(4-nitrophenyl)-2-(phenylalanylamino)butyramide Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C20H24N4O4/c1-13(2)18(20(26)22-15-8-10-16(11-9-15)24(27)28)23-19(25)17(21)12-14-6-4-3-5-7-14/h3-11,13,17-18H,12,21H2,1-2H3,(H,22,26)(H,23,25)