N-(2-cyano-3-methyl-butan-2-yl)-2-[(5-nitro-2-phenylazanyl-phenyl)amino]ethanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-[(5-nitro-2-phenylazanyl-phenyl)amino]ethanamide Openeye Name: 2-(2-anilino-5-nitro-anilino)-N-(1-cyano-1,2-dimethyl-propyl)acetamide CAS Name: 2-(2-anilino-5-nitroanilino)-N-(2-cyano-3-methylbutan-2-yl)acetamide IUPAC Name: 2-(2-anilino-5-nitroanilino)-N-(2-cyano-3-methylbutan-2-yl)acetamide Traditional Name: 2-(2-anilino-5-nitro-anilino)-N-(1-cyano-1,2-dimethyl-propyl)acetamide Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CNC1=C(C=CC(=C1)[N+](=O)[O-])NC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CNC1=C(C=CC(=C1)[N+](=O)[O-])NC2=CC=CC=C2

InChI

InChI=1S/C20H23N5O3/c1-14(2)20(3,13-21)24-19(26)12-22-18-11-16(25(27)28)9-10-17(18)23-15-7-5-4-6-8-15/h4-11,14,22-23H,12H2,1-3H3,(H,24,26)