methyl 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]carbonylpyridine-2-carboxylate

Systemtic Name: methyl 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]carbonylpyridine-2-carboxylate Openeye Name: methyl 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazine-1-carbonyl]pyridine-2-carboxylate CAS Name: 6-[[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazine-1-carbonyl]pyridine-2-carboxylate Traditional Name: 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazine-1-carbonyl]picolinic acid methyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O7S/c1-28-17-8-7-14(13-18(17)29-2)31(26,27)23-11-9-22(10-12-23)19(24)15-5-4-6-16(21-15)20(25)30-3/h4-8,13H,9-12H2,1-3H3