[4-(azepan-1-ylmethyl)phenyl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(azepan-1-ylmethyl)phenyl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Openeye Name: [4-(azepan-1-ylmethyl)phenyl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone CAS Name: [4-(1-azepanylmethyl)phenyl]-[4-(2,3-dimethylphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(azepan-1-ylmethyl)phenyl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Traditional Name: [4-(azepan-1-ylmethyl)phenyl]-[4-(2,3-dimethylphenyl)piperazino]methanone Formula: C26H35N3O MolecularWeight: 405.5756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCCCC4)C

InChI

InChI=1S/C26H35N3O/c1-21-8-7-9-25(22(21)2)28-16-18-29(19-17-28)26(30)24-12-10-23(11-13-24)20-27-14-5-3-4-6-15-27/h7-13H,3-6,14-20H2,1-2H3