2-(4-but-2-ynoxyphenyl)sulfonyl-2-methyl-N-oxidanyl-3-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]propanamide chloride

Systemtic Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-2-methyl-N-oxidanyl-3-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]propanamide chloride Openeye Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-2-methyl-3-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]propanehydroxamic acid chloride CAS Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-2-methyl-3-[4-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]propanamide chloride IUPAC Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-2-methyl-3-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]propanamide chloride Traditional Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-2-methyl-3-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]propanehydroxamic acid chloride Formula: C27H35ClN2O6S MolecularWeight: 551.0946

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C(C)(CC2=CC=C(C=C2)OCC[NH+]3CCCCC3)C(=O)NO.[Cl-]

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C(C)(CC2=CC=C(C=C2)OCC[NH+]3CCCCC3)C(=O)NO.[Cl-]

InChI

InChI=1S/C27H34N2O6S.ClH/c1-3-4-19-34-24-12-14-25(15-13-24)36(32,33)27(2,26(30)28-31)21-22-8-10-23(11-9-22)35-20-18-29-16-6-5-7-17-29;/h8-15,31H,5-7,16-21H2,1-2H3,(H,28,30);1H