2-(isothiocyanatomethyl)-1,3,5-trimethoxy-benzene

Systemtic Name: 2-(isothiocyanatomethyl)-1,3,5-trimethoxy-benzene Openeye Name: 2-(isothiocyanatomethyl)-1,3,5-trimethoxy-benzene CAS Name: 2-(isothiocyanatomethyl)-1,3,5-trimethoxybenzene IUPAC Name: 2-(isothiocyanatomethyl)-1,3,5-trimethoxybenzene Traditional Name: 2-(isothiocyanatomethyl)-1,3,5-trimethoxy-benzene Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CN=C=S)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CN=C=S)OC

InChI

InChI=1S/C11H13NO3S/c1-13-8-4-10(14-2)9(6-12-7-16)11(5-8)15-3/h4-5H,6H2,1-3H3