ethyl 4-azanyl-3-(2-ethoxy-1-methylsulfanyl-2-oxidanylidene-ethyl)benzoate

Systemtic Name: ethyl 4-azanyl-3-(2-ethoxy-1-methylsulfanyl-2-oxidanylidene-ethyl)benzoate Openeye Name: ethyl 4-amino-3-(2-ethoxy-1-methylsulfanyl-2-oxo-ethyl)benzoate CAS Name: 4-amino-3-[2-ethoxy-1-(methylthio)-2-oxoethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-(2-ethoxy-1-methylsulfanyl-2-oxoethyl)benzoate Traditional Name: 4-amino-3-[2-ethoxy-2-keto-1-(methylthio)ethyl]benzoic acid ethyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N)C(C(=O)OCC)SC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N)C(C(=O)OCC)SC

InChI

InChI=1S/C14H19NO4S/c1-4-18-13(16)9-6-7-11(15)10(8-9)12(20-3)14(17)19-5-2/h6-8,12H,4-5,15H2,1-3H3