7-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-2-phenylmethoxy-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 7-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-2-phenylmethoxy-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-benzyloxy-4-isopropyl-7-[[4-(p-tolyl)piperazin-1-yl]methyl]cyclohepta-2,4,6-trien-1-one CAS Name: 7-[[4-(4-methylphenyl)-1-piperazinyl]methyl]-2-phenylmethoxy-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-2-phenylmethoxy-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-benzoxy-4-isopropyl-7-[[4-(p-tolyl)piperazino]methyl]cyclohepta-2,4,6-trien-1-one Formula: C29H34N2O2 MolecularWeight: 442.59246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)CC3=CC=C(C=C(C3=O)OCC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)CC3=CC=C(C=C(C3=O)OCC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C29H34N2O2/c1-22(2)25-11-12-26(29(32)28(19-25)33-21-24-7-5-4-6-8-24)20-30-15-17-31(18-16-30)27-13-9-23(3)10-14-27/h4-14,19,22H,15-18,20-21H2,1-3H3