4-(4-methoxyphenyl)sulfonyl-N3-oxidanyl-N1-phenethyl-piperazine-1,3-dicarboxamide

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-N3-oxidanyl-N1-phenethyl-piperazine-1,3-dicarboxamide Openeye Name: 3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide CAS Name: N3-hydroxy-4-(4-methoxyphenyl)sulfonyl-N1-phenethylpiperazine-1,3-dicarboxamide IUPAC Name: 3-N-hydroxy-4-(4-methoxyphenyl)sulfonyl-1-N-phenethylpiperazine-1,3-dicarboxamide Traditional Name: 3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide Formula: C21H26N4O6S MolecularWeight: 462.51934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)NO)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)NO)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O6S/c1-31-17-7-9-18(10-8-17)32(29,30)25-14-13-24(15-19(25)20(26)23-28)21(27)22-12-11-16-5-3-2-4-6-16/h2-10,19,28H,11-15H2,1H3,(H,22,27)(H,23,26)