methyl 1-cyano-1-prop-2-enyl-isoquinoline-2-carboxylate

Systemtic Name: methyl 1-cyano-1-prop-2-enyl-isoquinoline-2-carboxylate Openeye Name: methyl 1-allyl-1-cyano-isoquinoline-2-carboxylate CAS Name: 1-cyano-1-prop-2-enyl-2-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-cyano-1-prop-2-enylisoquinoline-2-carboxylate Traditional Name: 1-allyl-1-cyano-isoquinoline-2-carboxylic acid methyl ester Formula: C15H14N2O2 MolecularWeight: 254.28386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C=CC2=CC=CC=C2C1(CC=C)C#N

Isomeric SMILES

COC(=O)N1C=CC2=CC=CC=C2C1(CC=C)C#N

InChI

InChI=1S/C15H14N2O2/c1-3-9-15(11-16)13-7-5-4-6-12(13)8-10-17(15)14(18)19-2/h3-8,10H,1,9H2,2H3