[2-(phenylmethoxymethyl)-4-sulfanyl-phenyl]methyl carbonochloridate

Systemtic Name: [2-(phenylmethoxymethyl)-4-sulfanyl-phenyl]methyl carbonochloridate Openeye Name: [2-(benzyloxymethyl)-4-sulfanyl-phenyl]methyl carbonochloridate CAS Name: carbonochloridic acid [4-mercapto-2-(phenylmethoxymethyl)phenyl]methyl ester IUPAC Name: [2-(phenylmethoxymethyl)-4-sulfanylphenyl]methyl carbonochloridate Traditional Name: chlorocarbonic acid [2-(benzoxymethyl)-4-mercapto-benzyl] ester Formula: C16H15ClO3S MolecularWeight: 322.8065

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=C(C=CC(=C2)S)COC(=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)COCC2=C(C=CC(=C2)S)COC(=O)Cl

InChI

InChI=1S/C16H15ClO3S/c17-16(18)20-11-13-6-7-15(21)8-14(13)10-19-9-12-4-2-1-3-5-12/h1-8,21H,9-11H2