N-[2-(azepan-1-yl)phenyl]-4-cyano-benzamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-4-cyano-benzamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-4-cyano-benzamide CAS Name: N-[2-(1-azepanyl)phenyl]-4-cyanobenzamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-4-cyanobenzamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-4-cyano-benzamide Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H21N3O/c21-15-16-9-11-17(12-10-16)20(24)22-18-7-3-4-8-19(18)23-13-5-1-2-6-14-23/h3-4,7-12H,1-2,5-6,13-14H2,(H,22,24)