diethyl 3-pyridin-2-yl-2H-isoquinoline-1,1-dicarboxylate

Systemtic Name: diethyl 3-pyridin-2-yl-2H-isoquinoline-1,1-dicarboxylate Openeye Name: diethyl 3-(2-pyridyl)-2H-isoquinoline-1,1-dicarboxylate CAS Name: 3-(2-pyridinyl)-2H-isoquinoline-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-pyridin-2-yl-2H-isoquinoline-1,1-dicarboxylate Traditional Name: 3-(2-pyridyl)-2H-isoquinoline-1,1-dicarboxylic acid diethyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=CC=CC=C2C=C(N1)C3=CC=CC=N3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C2=CC=CC=C2C=C(N1)C3=CC=CC=N3)C(=O)OCC

InChI

InChI=1S/C20H20N2O4/c1-3-25-18(23)20(19(24)26-4-2)15-10-6-5-9-14(15)13-17(22-20)16-11-7-8-12-21-16/h5-13,22H,3-4H2,1-2H3