1-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(3-oxidanylphenoxy)propan-1-one

Systemtic Name: 1-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(3-oxidanylphenoxy)propan-1-one Openeye Name: 1-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(3-hydroxyphenoxy)propan-1-one CAS Name: 1-[4-(2,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-3-(3-hydroxyphenoxy)-1-propanone IUPAC Name: 1-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(3-hydroxyphenoxy)propan-1-one Traditional Name: 1-[4-(2,4-dimethoxyphenyl)sulfonylpiperazino]-3-(3-hydroxyphenoxy)propan-1-one Formula: C21H26N2O7S MolecularWeight: 450.50534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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