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

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-2-nitro-benzamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-2-nitro-benzamide CAS Name: N-[2-(1-azepanyl)phenyl]-2-nitrobenzamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-2-nitrobenzamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-2-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(15-9-3-5-11-17(15)22(24)25)20-16-10-4-6-12-18(16)21-13-7-1-2-8-14-21/h3-6,9-12H,1-2,7-8,13-14H2,(H,20,23)