1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-(3,4-dimethoxyphenyl)-1-propanone IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-3-(3,4-dimethoxyphenyl)propan-1-one Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H27ClN2O3/c1-16-4-7-18(23)15-19(16)24-10-12-25(13-11-24)22(26)9-6-17-5-8-20(27-2)21(14-17)28-3/h4-5,7-8,14-15H,6,9-13H2,1-3H3