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

Systemtic Name: methyl 1-(4-methoxyphenyl)sulfonyl-5-oxidanylidene-piperazine-2-carboxylate Openeye Name: methyl 1-(4-methoxyphenyl)sulfonyl-5-oxo-piperazine-2-carboxylate CAS Name: 1-(4-methoxyphenyl)sulfonyl-5-oxo-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methoxyphenyl)sulfonyl-5-oxopiperazine-2-carboxylate Traditional Name: 5-keto-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylic acid methyl ester Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)NCC2C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)NCC2C(=O)OC

InChI

InChI=1S/C13H16N2O6S/c1-20-9-3-5-10(6-4-9)22(18,19)15-8-12(16)14-7-11(15)13(17)21-2/h3-6,11H,7-8H2,1-2H3,(H,14,16)