1-[3-methoxy-4-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[3-methoxy-4-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[4-[2-hydroxy-3-[4-(p-tolylsulfonyl)piperazin-1-yl]propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[2-hydroxy-3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]propoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[2-hydroxy-3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[2-hydroxy-3-(4-tosylpiperazino)propoxy]-3-methoxy-phenyl]ethanone Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O6S/c1-17-4-7-21(8-5-17)32(28,29)25-12-10-24(11-13-25)15-20(27)16-31-22-9-6-19(18(2)26)14-23(22)30-3/h4-9,14,20,27H,10-13,15-16H2,1-3H3