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

Systemtic Name: 2-butoxy-7-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-butoxy-7-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-butoxy-7-[[4-(2-chlorophenyl)-1-piperazinyl]methyl]-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-butoxy-7-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-butoxy-7-[[4-(2-chlorophenyl)piperazino]methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one Formula: C25H33ClN2O2 MolecularWeight: 428.99472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC=CC=C3Cl)C(C)C

Isomeric SMILES

CCCCOC1=CC(=CC=C(C1=O)CN2CCN(CC2)C3=CC=CC=C3Cl)C(C)C

InChI

InChI=1S/C25H33ClN2O2/c1-4-5-16-30-24-17-20(19(2)3)10-11-21(25(24)29)18-27-12-14-28(15-13-27)23-9-7-6-8-22(23)26/h6-11,17,19H,4-5,12-16,18H2,1-3H3