N-(3-cyanophenyl)-2-[1-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide

Systemtic Name: N-(3-cyanophenyl)-2-[1-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide Openeye Name: N-(3-cyanophenyl)-2-(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide CAS Name: N-(3-cyanophenyl)-2-(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-(3-cyanophenyl)-2-(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-(3-cyanophenyl)-2-(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1CC(=O)NC3=CC=CC(=C3)C#N)O)O

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1CC(=O)NC3=CC=CC(=C3)C#N)O)O

InChI

InChI=1S/C19H19N3O3/c1-12-16-9-18(24)17(23)8-14(16)5-6-22(12)11-19(25)21-15-4-2-3-13(7-15)10-20/h2-4,7-9,12,23-24H,5-6,11H2,1H3,(H,21,25)