N-[4-(azepan-1-yl)phenyl]-2-[(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[(3-nitrophenyl)amino]ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-(3-nitroanilino)acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-(3-nitroanilino)acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-(3-nitroanilino)acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-(3-nitroanilino)acetamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c25-20(15-21-17-6-5-7-19(14-17)24(26)27)22-16-8-10-18(11-9-16)23-12-3-1-2-4-13-23/h5-11,14,21H,1-4,12-13,15H2,(H,22,25)