[1-[(4-methoxyphenyl)methyl]-4-(4-prop-2-ynoxyphenyl)sulfonyl-piperidin-4-yl] N-oxidanylcarbamate

Systemtic Name: [1-[(4-methoxyphenyl)methyl]-4-(4-prop-2-ynoxyphenyl)sulfonyl-piperidin-4-yl] N-oxidanylcarbamate Openeye Name: [1-[(4-methoxyphenyl)methyl]-4-(4-prop-2-ynoxyphenyl)sulfonyl-4-piperidyl] N-hydroxycarbamate CAS Name: N-hydroxycarbamic acid [1-[(4-methoxyphenyl)methyl]-4-(4-prop-2-ynoxyphenyl)sulfonyl-4-piperidinyl] ester IUPAC Name: [1-[(4-methoxyphenyl)methyl]-4-(4-prop-2-ynoxyphenyl)sulfonylpiperidin-4-yl] N-hydroxycarbamate Traditional Name: N-hydroxycarbamic acid [1-p-anisyl-4-(4-propargyloxyphenyl)sulfonyl-4-piperidyl] ester Formula: C23H26N2O7S MolecularWeight: 474.52674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCC(CC2)(OC(=O)NO)S(=O)(=O)C3=CC=C(C=C3)OCC#C

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCC(CC2)(OC(=O)NO)S(=O)(=O)C3=CC=C(C=C3)OCC#C

InChI

InChI=1S/C23H26N2O7S/c1-3-16-31-20-8-10-21(11-9-20)33(28,29)23(32-22(26)24-27)12-14-25(15-13-23)17-18-4-6-19(30-2)7-5-18/h1,4-11,27H,12-17H2,2H3,(H,24,26)