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

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-4-[(2-nitrophenyl)amino]butanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-4-(2-nitroanilino)butanamide CAS Name: N-(3-fluoro-4-methylphenyl)-4-(2-nitroanilino)butanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-4-(2-nitroanilino)butanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-4-(2-nitroanilino)butyramide Formula: C17H18FN3O3 MolecularWeight: 331.341523

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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-])F

Isomeric SMILES

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

InChI

InChI=1S/C17H18FN3O3/c1-12-8-9-13(11-14(12)18)20-17(22)7-4-10-19-15-5-2-3-6-16(15)21(23)24/h2-3,5-6,8-9,11,19H,4,7,10H2,1H3,(H,20,22)