methyl (1S)-1-cyano-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: methyl (1S)-1-cyano-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: methyl (1S)-1-cyano-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: (1S)-1-cyano-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester IUPAC Name: methyl (1S)-1-cyano-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: (1S)-1-cyano-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC2=CC=CC=C2C1C#N

Isomeric SMILES

COC(=O)N1CCC2=CC=CC=C2[C@H]1C#N

InChI

InChI=1S/C12H12N2O2/c1-16-12(15)14-7-6-9-4-2-3-5-10(9)11(14)8-13/h2-5,11H,6-7H2,1H3/t11-/m1/s1