1-[4-[3-[4-(3-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methoxy-phenyl]ethanone

Systemtic Name: 1-[4-[3-[4-(3-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-[3-[4-(3-chloro-2-methyl-phenyl)piperazin-1-yl]-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[3-[4-(3-chloro-2-methylphenyl)-1-piperazinyl]-2-hydroxypropoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[3-[4-(3-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[3-[4-(3-chloro-2-methyl-phenyl)piperazino]-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone Formula: C23H29ClN2O4 MolecularWeight: 432.94036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C(=O)C)OC)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C(=O)C)OC)O

InChI

InChI=1S/C23H29ClN2O4/c1-16-20(24)5-4-6-21(16)26-11-9-25(10-12-26)14-19(28)15-30-22-8-7-18(17(2)27)13-23(22)29-3/h4-8,13,19,28H,9-12,14-15H2,1-3H3