1-(azepan-1-yl)-2-[(3-nitrophenyl)amino]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[(3-nitrophenyl)amino]ethanone Openeye Name: 1-(azepan-1-yl)-2-(3-nitroanilino)ethanone CAS Name: 1-(1-azepanyl)-2-(3-nitroanilino)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(3-nitroanilino)ethanone Traditional Name: 1-(azepan-1-yl)-2-(3-nitroanilino)ethanone Formula: C14H19N3O3 MolecularWeight: 277.31896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)CNC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O3/c18-14(16-8-3-1-2-4-9-16)11-15-12-6-5-7-13(10-12)17(19)20/h5-7,10,15H,1-4,8-9,11H2