1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-oxidanylphenoxy)propan-1-one

Systemtic Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-oxidanylphenoxy)propan-1-one Openeye Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-hydroxyphenoxy)propan-1-one CAS Name: 1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-3-(4-hydroxyphenoxy)-1-propanone IUPAC Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-hydroxyphenoxy)propan-1-one Traditional Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-3-(4-hydroxyphenoxy)propan-1-one Formula: C21H26N2O7S MolecularWeight: 450.50534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCOC3=CC=C(C=C3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCOC3=CC=C(C=C3)O)OC

InChI

InChI=1S/C21H26N2O7S/c1-28-19-8-7-18(15-20(19)29-2)31(26,27)23-12-10-22(11-13-23)21(25)9-14-30-17-5-3-16(24)4-6-17/h3-8,15,24H,9-14H2,1-2H3