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

Systemtic Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-4-cyano-benzamide Openeye Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-4-cyano-benzamide CAS Name: N-[2-[4-(1-azepanyl)phenyl]ethyl]-4-cyanobenzamide IUPAC Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-4-cyanobenzamide Traditional Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-4-cyano-benzamide Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O/c23-17-19-5-9-20(10-6-19)22(26)24-14-13-18-7-11-21(12-8-18)25-15-3-1-2-4-16-25/h5-12H,1-4,13-16H2,(H,24,26)