methyl 3-(1-cyano-2-methoxy-2-oxidanylidene-ethyl)indole-1-carboxylate

Systemtic Name: methyl 3-(1-cyano-2-methoxy-2-oxidanylidene-ethyl)indole-1-carboxylate Openeye Name: methyl 3-(1-cyano-2-methoxy-2-oxo-ethyl)indole-1-carboxylate CAS Name: 3-(1-cyano-2-methoxy-2-oxoethyl)-1-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(1-cyano-2-methoxy-2-oxoethyl)indole-1-carboxylate Traditional Name: 3-(1-cyano-2-keto-2-methoxy-ethyl)indole-1-carboxylic acid methyl ester Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=CN(C2=CC=CC=C21)C(=O)OC

Isomeric SMILES

COC(=O)C(C#N)C1=CN(C2=CC=CC=C21)C(=O)OC

InChI

InChI=1S/C14H12N2O4/c1-19-13(17)10(7-15)11-8-16(14(18)20-2)12-6-4-3-5-9(11)12/h3-6,8,10H,1-2H3