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

Systemtic Name: 2-butoxy-7-[[4-(2,4-dimethylphenyl)piperazin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-butoxy-7-[[4-(2,4-dimethylphenyl)piperazin-1-yl]methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-butoxy-7-[[4-(2,4-dimethylphenyl)-1-piperazinyl]methyl]-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-butoxy-7-[[4-(2,4-dimethylphenyl)piperazin-1-yl]methyl]-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-butoxy-7-[[4-(2,4-dimethylphenyl)piperazino]methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one Formula: C27H38N2O2 MolecularWeight: 422.60282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38N2O2/c1-6-7-16-31-26-18-23(20(2)3)9-10-24(27(26)30)19-28-12-14-29(15-13-28)25-11-8-21(4)17-22(25)5/h8-11,17-18,20H,6-7,12-16,19H2,1-5H3