methyl 3-[(E)-1-cyano-2-ethoxy-2-oxidanyl-ethenyl]-2-methyl-1-oxidanylidene-3H-isoindole-5-carboxylate

Systemtic Name: methyl 3-[(E)-1-cyano-2-ethoxy-2-oxidanyl-ethenyl]-2-methyl-1-oxidanylidene-3H-isoindole-5-carboxylate Openeye Name: methyl 3-[(E)-1-cyano-2-ethoxy-2-hydroxy-vinyl]-2-methyl-1-oxo-isoindoline-5-carboxylate CAS Name: 3-[(E)-1-cyano-2-ethoxy-2-hydroxyethenyl]-2-methyl-1-oxo-3H-isoindole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-1-cyano-2-ethoxy-2-hydroxyethenyl]-2-methyl-1-oxo-3H-isoindole-5-carboxylate Traditional Name: 3-[(E)-1-cyano-2-ethoxy-2-hydroxy-vinyl]-1-keto-2-methyl-isoindoline-5-carboxylic acid methyl ester Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C1C2=C(C=CC(=C2)C(=O)OC)C(=O)N1C)O

Isomeric SMILES

CCO/C(=C(/C#N)\C1C2=C(C=CC(=C2)C(=O)OC)C(=O)N1C)/O

InChI

InChI=1S/C16H16N2O5/c1-4-23-16(21)12(8-17)13-11-7-9(15(20)22-3)5-6-10(11)14(19)18(13)2/h5-7,13,21H,4H2,1-3H3/b16-12-