ethyl 6,7-dimethoxy-1-[oxidanyl(phenyl)methyl]isoquinoline-4-carboxylate

Systemtic Name: ethyl 6,7-dimethoxy-1-[oxidanyl(phenyl)methyl]isoquinoline-4-carboxylate Openeye Name: ethyl 1-[hydroxy(phenyl)methyl]-6,7-dimethoxy-isoquinoline-4-carboxylate CAS Name: 1-[hydroxy(phenyl)methyl]-6,7-dimethoxy-4-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[hydroxy(phenyl)methyl]-6,7-dimethoxyisoquinoline-4-carboxylate Traditional Name: 1-[hydroxy(phenyl)methyl]-6,7-dimethoxy-isoquinoline-4-carboxylic acid ethyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)C(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)C(C3=CC=CC=C3)O

InChI

InChI=1S/C21H21NO5/c1-4-27-21(24)16-12-22-19(20(23)13-8-6-5-7-9-13)15-11-18(26-3)17(25-2)10-14(15)16/h5-12,20,23H,4H2,1-3H3