[4-(azepan-1-ylmethyl)phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4-(azepan-1-ylmethyl)phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: [4-(azepan-1-ylmethyl)phenyl]-(4-benzylpiperazin-1-yl)methanone CAS Name: [4-(1-azepanylmethyl)phenyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: [4-(azepan-1-ylmethyl)phenyl]-(4-benzylpiperazin-1-yl)methanone Traditional Name: [4-(azepan-1-ylmethyl)phenyl]-(4-benzylpiperazino)methanone Formula: C25H33N3O MolecularWeight: 391.54902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O/c29-25(28-18-16-27(17-19-28)20-22-8-4-3-5-9-22)24-12-10-23(11-13-24)21-26-14-6-1-2-7-15-26/h3-5,8-13H,1-2,6-7,14-21H2