7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-methoxy-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-methoxy-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-4-isopropyl-2-methoxy-cyclohepta-2,4,6-trien-1-one CAS Name: 7-[[4-(3-chlorophenyl)-1-piperazinyl]methyl]-2-methoxy-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-methoxy-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 7-[[4-(3-chlorophenyl)piperazino]methyl]-4-isopropyl-2-methoxy-cyclohepta-2,4,6-trien-1-one Formula: C22H27ClN2O2 MolecularWeight: 386.91498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C(=O)C(=C1)OC)CN2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)C1=CC=C(C(=O)C(=C1)OC)CN2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H27ClN2O2/c1-16(2)17-7-8-18(22(26)21(13-17)27-3)15-24-9-11-25(12-10-24)20-6-4-5-19(23)14-20/h4-8,13-14,16H,9-12,15H2,1-3H3