cyanomethyl 4,6-dimethyl-1H-indole-2-carboxylate

Systemtic Name: cyanomethyl 4,6-dimethyl-1H-indole-2-carboxylate Openeye Name: cyanomethyl 4,6-dimethyl-1H-indole-2-carboxylate CAS Name: 4,6-dimethyl-1H-indole-2-carboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 4,6-dimethyl-1H-indole-2-carboxylate Traditional Name: 4,6-dimethyl-1H-indole-2-carboxylic acid cyanomethyl ester Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC2=C1)C(=O)OCC#N)C

Isomeric SMILES

CC1=CC(=C2C=C(NC2=C1)C(=O)OCC#N)C

InChI

InChI=1S/C13H12N2O2/c1-8-5-9(2)10-7-12(15-11(10)6-8)13(16)17-4-3-14/h5-7,15H,4H2,1-2H3