4-(4-chloranyl-2-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one CAS Name: 4-(4-chloro-2-methylphenoxy)-1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-chloro-2-methylphenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazino]butan-1-one Formula: C23H29ClN2O2 MolecularWeight: 400.94156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)Cl)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)Cl)C)C

InChI

InChI=1S/C23H29ClN2O2/c1-17-6-4-7-21(19(17)3)25-11-13-26(14-12-25)23(27)8-5-15-28-22-10-9-20(24)16-18(22)2/h4,6-7,9-10,16H,5,8,11-15H2,1-3H3