O-ethyl 3-methoxy-4-propoxy-benzenecarbothioate

Systemtic Name: O-ethyl 3-methoxy-4-propoxy-benzenecarbothioate Openeye Name: O-ethyl 3-methoxy-4-propoxy-benzenecarbothioate CAS Name: 3-methoxy-4-propoxybenzenecarbothioic acid O-ethyl ester IUPAC Name: O-ethyl 3-methoxy-4-propoxybenzenecarbothioate Traditional Name: 3-methoxy-4-propoxy-thiobenzoic acid O-ethyl ester Formula: C13H18O3S MolecularWeight: 254.34522

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=S)OCC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=S)OCC)OC

InChI

InChI=1S/C13H18O3S/c1-4-8-16-11-7-6-10(9-12(11)14-3)13(17)15-5-2/h6-7,9H,4-5,8H2,1-3H3