(phenylmethyl) 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate

Systemtic Name: (phenylmethyl) 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate Openeye Name: benzyl 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate CAS Name: 1-cyano-3-methyl-1H-isoquinoline-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-cyano-3-methyl-1H-isoquinoline-2-carboxylate Traditional Name: 1-cyano-3-methyl-1H-isoquinoline-2-carboxylic acid benzyl ester Formula: C19H16N2O2 MolecularWeight: 304.34254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(N1C(=O)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC2=CC=CC=C2C(N1C(=O)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C19H16N2O2/c1-14-11-16-9-5-6-10-17(16)18(12-20)21(14)19(22)23-13-15-7-3-2-4-8-15/h2-11,18H,13H2,1H3