2-(azepan-1-yl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: 2-(azepan-1-yl)-N-[4-(4-benzylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-(1-azepanyl)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-[4-(4-benzylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-(azepan-1-yl)-N-[4-(4-benzylpiperazino)phenyl]acetamide Formula: C25H34N4O MolecularWeight: 406.56366

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H34N4O/c30-25(21-27-14-6-1-2-7-15-27)26-23-10-12-24(13-11-23)29-18-16-28(17-19-29)20-22-8-4-3-5-9-22/h3-5,8-13H,1-2,6-7,14-21H2,(H,26,30)