ethyl (E)-3-[2-(acetyloxymethylsulfanyl)-1-cyano-indolizin-3-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[2-(acetyloxymethylsulfanyl)-1-cyano-indolizin-3-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[2-(acetoxymethylsulfanyl)-1-cyano-indolizin-3-yl]prop-2-enoate CAS Name: (E)-3-[2-(acetyloxymethylthio)-1-cyano-3-indolizinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-(acetyloxymethylsulfanyl)-1-cyanoindolizin-3-yl]prop-2-enoate Traditional Name: (E)-3-[2-(acetoxymethylthio)-1-cyano-indolizin-3-yl]acrylic acid ethyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C(=C2N1C=CC=C2)C#N)SCOC(=O)C

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C(=C2N1C=CC=C2)C#N)SCOC(=O)C

InChI

InChI=1S/C17H16N2O4S/c1-3-22-16(21)8-7-15-17(24-11-23-12(2)20)13(10-18)14-6-4-5-9-19(14)15/h4-9H,3,11H2,1-2H3/b8-7+