octyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-(oxidanylcarbamoyl)piperidine-1-carboxylate

Systemtic Name: octyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-(oxidanylcarbamoyl)piperidine-1-carboxylate Openeye Name: octyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-(hydroxycarbamoyl)piperidine-1-carboxylate CAS Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-[(hydroxyamino)-oxomethyl]-1-piperidinecarboxylic acid octyl ester IUPAC Name: octyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-(hydroxycarbamoyl)piperidine-1-carboxylate Traditional Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-(hydroxycarbamoyl)piperidine-1-carboxylic acid octyl ester Formula: C26H38N2O7S MolecularWeight: 522.65412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)N1CCC(CC1)(CS(=O)(=O)C2=CC=C(C=C2)OCC#CC)C(=O)NO

Isomeric SMILES

CCCCCCCCOC(=O)N1CCC(CC1)(CS(=O)(=O)C2=CC=C(C=C2)OCC#CC)C(=O)NO

InChI

InChI=1S/C26H38N2O7S/c1-3-5-7-8-9-10-20-35-25(30)28-17-15-26(16-18-28,24(29)27-31)21-36(32,33)23-13-11-22(12-14-23)34-19-6-4-2/h11-14,31H,3,5,7-10,15-21H2,1-2H3,(H,27,29)