N-[2-(azepan-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-3-nitro-benzamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-3-nitro-benzamide CAS Name: N-[2-(1-azepanyl)phenyl]-3-nitrobenzamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-3-nitrobenzamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-3-nitro-benzamide Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3/c23-19(15-8-7-9-16(14-15)22(24)25)20-17-10-3-4-11-18(17)21-12-5-1-2-6-13-21/h3-4,7-11,14H,1-2,5-6,12-13H2,(H,20,23)