methyl 3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-2-methylsulfanyl-indolizine-1-carboxylate

Systemtic Name: methyl 3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-2-methylsulfanyl-indolizine-1-carboxylate Openeye Name: methyl 3-[(E)-3-ethoxy-3-oxo-prop-1-enyl]-2-methylsulfanyl-indolizine-1-carboxylate CAS Name: 3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-2-(methylthio)-1-indolizinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-2-methylsulfanylindolizine-1-carboxylate Traditional Name: 3-[(E)-3-ethoxy-3-keto-prop-1-enyl]-2-(methylthio)indolizine-1-carboxylic acid methyl ester Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C(=C2N1C=CC=C2)C(=O)OC)SC

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C(=C2N1C=CC=C2)C(=O)OC)SC

InChI

InChI=1S/C16H17NO4S/c1-4-21-13(18)9-8-12-15(22-3)14(16(19)20-2)11-7-5-6-10-17(11)12/h5-10H,4H2,1-3H3/b9-8+