8-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 8-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 8-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]quinoline CAS Name: 8-[[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 8-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 8-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]methyl]quinoline Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4)OC

InChI

InChI=1S/C22H25N3O4S/c1-28-20-9-8-19(15-21(20)29-2)30(26,27)25-13-11-24(12-14-25)16-18-6-3-5-17-7-4-10-23-22(17)18/h3-10,15H,11-14,16H2,1-2H3