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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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