1-[4-[3-[4-(2,6-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methoxy-phenyl]ethanone

Systemtic Name: 1-[4-[3-[4-(2,6-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-[3-[4-(2,6-dimethylphenyl)piperazin-1-yl]-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[3-[4-(2,6-dimethylphenyl)-1-piperazinyl]-2-hydroxypropoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[3-[4-(2,6-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[3-[4-(2,6-dimethylphenyl)piperazino]-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C(=O)C)OC)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C(=O)C)OC)O

InChI

InChI=1S/C24H32N2O4/c1-17-6-5-7-18(2)24(17)26-12-10-25(11-13-26)15-21(28)16-30-22-9-8-20(19(3)27)14-23(22)29-4/h5-9,14,21,28H,10-13,15-16H2,1-4H3