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

Systemtic Name: 5-(2-isothiocyanatoethyl)-1,2,3-trimethoxy-benzene Openeye Name: 5-(2-isothiocyanatoethyl)-1,2,3-trimethoxy-benzene CAS Name: 5-(2-isothiocyanatoethyl)-1,2,3-trimethoxybenzene IUPAC Name: 5-(2-isothiocyanatoethyl)-1,2,3-trimethoxybenzene Traditional Name: 5-(2-isothiocyanatoethyl)-1,2,3-trimethoxy-benzene Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCN=C=S

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCN=C=S

InChI

InChI=1S/C12H15NO3S/c1-14-10-6-9(4-5-13-8-17)7-11(15-2)12(10)16-3/h6-7H,4-5H2,1-3H3