[2-(hydroxymethyl)-2-methyl-1-oxidanyl-pentyl] carbamate; N-propan-2-ylsulfanylcarbamate

Systemtic Name: [2-(hydroxymethyl)-2-methyl-1-oxidanyl-pentyl] carbamate; N-propan-2-ylsulfanylcarbamate Openeye Name: [1-hydroxy-2-(hydroxymethyl)-2-methyl-pentyl] carbamate; N-isopropylsulfanylcarbamate CAS Name: carbamic acid [1-hydroxy-2-(hydroxymethyl)-2-methylpentyl] ester; N-(propan-2-ylthio)carbamate IUPAC Name: [1-hydroxy-2-(hydroxymethyl)-2-methylpentyl] carbamate; N-propan-2-ylsulfanylcarbamate Traditional Name: carbamic acid (1-hydroxy-2-methyl-2-methylol-pentyl) ester; N-(isopropylthio)carbamate Formula: C12H25N2O6S- MolecularWeight: 325.4017

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CO)C(O)OC(=O)N.CC(C)SNC(=O)[O-]

Isomeric SMILES

CCCC(C)(CO)C(O)OC(=O)N.CC(C)SNC(=O)[O-]

InChI

InChI=1S/C8H17NO4.C4H9NO2S/c1-3-4-8(2,5-10)6(11)13-7(9)12;1-3(2)8-5-4(6)7/h6,10-11H,3-5H2,1-2H3,(H2,9,12);3,5H,1-2H3,(H,6,7)/p-1