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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-4-[(4-nitrophenyl)amino]butanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-4-(4-nitroanilino)butanamide CAS Name: N-(4-bromo-2-methylphenyl)-4-(4-nitroanilino)butanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-4-(4-nitroanilino)butanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-(4-nitroanilino)butyramide Formula: C17H18BrN3O3 MolecularWeight: 392.24712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O3/c1-12-11-13(18)4-9-16(12)20-17(22)3-2-10-19-14-5-7-15(8-6-14)21(23)24/h4-9,11,19H,2-3,10H2,1H3,(H,20,22)