[4-(4-but-2-ynoxyphenyl)sulfonyl-1-[(4-methylphenyl)methyl]piperidin-4-yl] N-oxidanylcarbamate

Systemtic Name: [4-(4-but-2-ynoxyphenyl)sulfonyl-1-[(4-methylphenyl)methyl]piperidin-4-yl] N-oxidanylcarbamate Openeye Name: [4-(4-but-2-ynoxyphenyl)sulfonyl-1-(p-tolylmethyl)-4-piperidyl] N-hydroxycarbamate CAS Name: N-hydroxycarbamic acid [4-(4-but-2-ynoxyphenyl)sulfonyl-1-[(4-methylphenyl)methyl]-4-piperidinyl] ester IUPAC Name: [4-(4-but-2-ynoxyphenyl)sulfonyl-1-[(4-methylphenyl)methyl]piperidin-4-yl] N-hydroxycarbamate Traditional Name: N-hydroxycarbamic acid [4-(4-but-2-ynoxyphenyl)sulfonyl-1-(4-methylbenzyl)-4-piperidyl] ester Formula: C24H28N2O6S MolecularWeight: 472.55392

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)CC3=CC=C(C=C3)C)OC(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)CC3=CC=C(C=C3)C)OC(=O)NO

InChI

InChI=1S/C24H28N2O6S/c1-3-4-17-31-21-9-11-22(12-10-21)33(29,30)24(32-23(27)25-28)13-15-26(16-14-24)18-20-7-5-19(2)6-8-20/h5-12,28H,13-18H2,1-2H3,(H,25,27)