ethyl 3-[isoquinolin-3-yl(oxidanyl)methyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[isoquinolin-3-yl(oxidanyl)methyl]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[hydroxy(3-isoquinolyl)methyl]-1H-indole-2-carboxylate CAS Name: 3-[hydroxy(3-isoquinolinyl)methyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[hydroxy(isoquinolin-3-yl)methyl]-1H-indole-2-carboxylate Traditional Name: 3-[hydroxy(3-isoquinolyl)methyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)C(C3=CC4=CC=CC=C4C=N3)O

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)C(C3=CC4=CC=CC=C4C=N3)O

InChI

InChI=1S/C21H18N2O3/c1-2-26-21(25)19-18(15-9-5-6-10-16(15)23-19)20(24)17-11-13-7-3-4-8-14(13)12-22-17/h3-12,20,23-24H,2H2,1H3