2-ethoxy-2-(ethylsulfanylmethyl)-1,3-benzodioxole; N-methylcarbamate

Systemtic Name: 2-ethoxy-2-(ethylsulfanylmethyl)-1,3-benzodioxole; N-methylcarbamate Openeye Name: 2-ethoxy-2-(ethylsulfanylmethyl)-1,3-benzodioxole; N-methylcarbamate CAS Name: 2-ethoxy-2-[(ethylthio)methyl]-1,3-benzodioxole; N-methylcarbamate IUPAC Name: 2-ethoxy-2-(ethylsulfanylmethyl)-1,3-benzodioxole; N-methylcarbamate Traditional Name: 2-ethoxy-2-[(ethylthio)methyl]-1,3-benzodioxole; N-methylcarbamate Formula: C14H20NO5S- MolecularWeight: 314.3773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1(OC2=CC=CC=C2O1)CSCC.CNC(=O)[O-]

Isomeric SMILES

CCOC1(OC2=CC=CC=C2O1)CSCC.CNC(=O)[O-]

InChI

InChI=1S/C12H16O3S.C2H5NO2/c1-3-13-12(9-16-4-2)14-10-7-5-6-8-11(10)15-12;1-3-2(4)5/h5-8H,3-4,9H2,1-2H3;3H,1H3,(H,4,5)/p-1