(2E)-1-[4-(4-chlorophenyl)-2-methyl-2-piperazin-1-yl-cyclohexyl]penta-2,4-dien-1-one

Systemtic Name: (2E)-1-[4-(4-chlorophenyl)-2-methyl-2-piperazin-1-yl-cyclohexyl]penta-2,4-dien-1-one Openeye Name: (2E)-1-[4-(4-chlorophenyl)-2-methyl-2-piperazin-1-yl-cyclohexyl]penta-2,4-dien-1-one CAS Name: (2E)-1-[4-(4-chlorophenyl)-2-methyl-2-(1-piperazinyl)cyclohexyl]-1-penta-2,4-dienone IUPAC Name: (2E)-1-[4-(4-chlorophenyl)-2-methyl-2-piperazin-1-ylcyclohexyl]penta-2,4-dien-1-one Traditional Name: (2E)-1-[4-(4-chlorophenyl)-2-methyl-2-piperazino-cyclohexyl]penta-2,4-dien-1-one Formula: C22H29ClN2O MolecularWeight: 372.93146

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCC1C(=O)C=CC=C)C2=CC=C(C=C2)Cl)N3CCNCC3

Isomeric SMILES

CC1(CC(CCC1C(=O)/C=C/C=C)C2=CC=C(C=C2)Cl)N3CCNCC3

InChI

InChI=1S/C22H29ClN2O/c1-3-4-5-21(26)20-11-8-18(17-6-9-19(23)10-7-17)16-22(20,2)25-14-12-24-13-15-25/h3-7,9-10,18,20,24H,1,8,11-16H2,2H3/b5-4+