N-(2,3-dimethylphenyl)-4-[(4-nitrophenyl)amino]butanamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-[(4-nitrophenyl)amino]butanamide Openeye Name: N-(2,3-dimethylphenyl)-4-(4-nitroanilino)butanamide CAS Name: N-(2,3-dimethylphenyl)-4-(4-nitroanilino)butanamide IUPAC Name: N-(2,3-dimethylphenyl)-4-(4-nitroanilino)butanamide Traditional Name: N-(2,3-dimethylphenyl)-4-(4-nitroanilino)butyramide Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O3/c1-13-5-3-6-17(14(13)2)20-18(22)7-4-12-19-15-8-10-16(11-9-15)21(23)24/h3,5-6,8-11,19H,4,7,12H2,1-2H3,(H,20,22)