[5-(hydroxymethyl)-3-methoxy-2-oxidanyl-phenyl]methyl N,N-diethylcarbamodithioate

Systemtic Name: [5-(hydroxymethyl)-3-methoxy-2-oxidanyl-phenyl]methyl N,N-diethylcarbamodithioate Openeye Name: [2-hydroxy-5-(hydroxymethyl)-3-methoxy-phenyl]methyl N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-hydroxy-5-(hydroxymethyl)-3-methoxyphenyl]methyl ester IUPAC Name: [2-hydroxy-5-(hydroxymethyl)-3-methoxyphenyl]methyl N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid (2-hydroxy-3-methoxy-5-methylol-benzyl) ester Formula: C14H21NO3S2 MolecularWeight: 315.45144

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC1=C(C(=CC(=C1)CO)OC)O

Isomeric SMILES

CCN(CC)C(=S)SCC1=C(C(=CC(=C1)CO)OC)O

InChI

InChI=1S/C14H21NO3S2/c1-4-15(5-2)14(19)20-9-11-6-10(8-16)7-12(18-3)13(11)17/h6-7,16-17H,4-5,8-9H2,1-3H3