methyl 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethylcarbamoyl]benzoate

Systemtic Name: methyl 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethylcarbamoyl]benzoate Openeye Name: methyl 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethylcarbamoyl]benzoate CAS Name: 2-[[2-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethylcarbamoyl]benzoate Traditional Name: 2-[2-[4-(2-methoxyphenyl)piperazino]sulfonylethylcarbamoyl]benzoic acid methyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC=CC=C3C(=O)OC

InChI

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