methyl 1-(4-methoxyphenyl)sulfonyl-4-(phenethylcarbamoyl)piperazine-2-carboxylate

Systemtic Name: methyl 1-(4-methoxyphenyl)sulfonyl-4-(phenethylcarbamoyl)piperazine-2-carboxylate Openeye Name: methyl 1-(4-methoxyphenyl)sulfonyl-4-(phenethylcarbamoyl)piperazine-2-carboxylate CAS Name: 1-(4-methoxyphenyl)sulfonyl-4-[oxo-(phenethylamino)methyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methoxyphenyl)sulfonyl-4-(phenethylcarbamoyl)piperazine-2-carboxylate Traditional Name: 1-(4-methoxyphenyl)sulfonyl-4-(phenethylcarbamoyl)piperazine-2-carboxylic acid methyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)OC)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)OC)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O6S/c1-30-18-8-10-19(11-9-18)32(28,29)25-15-14-24(16-20(25)21(26)31-2)22(27)23-13-12-17-6-4-3-5-7-17/h3-11,20H,12-16H2,1-2H3,(H,23,27)