methyl 1-(4-methoxyphenyl)sulfonyl-5-oxidanylidene-4-(2-pyridin-2-ylethyl)piperazine-2-carboxylate

Systemtic Name: methyl 1-(4-methoxyphenyl)sulfonyl-5-oxidanylidene-4-(2-pyridin-2-ylethyl)piperazine-2-carboxylate Openeye Name: methyl 1-(4-methoxyphenyl)sulfonyl-5-oxo-4-[2-(2-pyridyl)ethyl]piperazine-2-carboxylate CAS Name: 1-(4-methoxyphenyl)sulfonyl-5-oxo-4-[2-(2-pyridinyl)ethyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methoxyphenyl)sulfonyl-5-oxo-4-(2-pyridin-2-ylethyl)piperazine-2-carboxylate Traditional Name: 5-keto-1-(4-methoxyphenyl)sulfonyl-4-[2-(2-pyridyl)ethyl]piperazine-2-carboxylic acid methyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(CC2C(=O)OC)CCC3=CC=CC=N3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(CC2C(=O)OC)CCC3=CC=CC=N3

InChI

InChI=1S/C20H23N3O6S/c1-28-16-6-8-17(9-7-16)30(26,27)23-14-19(24)22(13-18(23)20(25)29-2)12-10-15-5-3-4-11-21-15/h3-9,11,18H,10,12-14H2,1-2H3