N-[2-(azepan-1-yl)phenyl]-2-(benzotriazol-1-yl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-2-(benzotriazol-1-yl)ethanamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-2-(benzotriazol-1-yl)acetamide CAS Name: N-[2-(1-azepanyl)phenyl]-2-(1-benzotriazolyl)acetamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-2-(benzotriazol-1-yl)acetamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-2-(benzotriazol-1-yl)acetamide Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H23N5O/c26-20(15-25-19-12-6-4-10-17(19)22-23-25)21-16-9-3-5-11-18(16)24-13-7-1-2-8-14-24/h3-6,9-12H,1-2,7-8,13-15H2,(H,21,26)