2-(6,7-dimethoxycinnolin-4-yl)-3,4-dihydro-1H-isoquinoline-5-carboxylic acid

Systemtic Name: 2-(6,7-dimethoxycinnolin-4-yl)-3,4-dihydro-1H-isoquinoline-5-carboxylic acid Openeye Name: 2-(6,7-dimethoxycinnolin-4-yl)-3,4-dihydro-1H-isoquinoline-5-carboxylic acid CAS Name: 2-(6,7-dimethoxy-4-cinnolinyl)-3,4-dihydro-1H-isoquinoline-5-carboxylic acid IUPAC Name: 2-(6,7-dimethoxycinnolin-4-yl)-3,4-dihydro-1H-isoquinoline-5-carboxylic acid Traditional Name: 2-(6,7-dimethoxycinnolin-4-yl)-3,4-dihydro-1H-isoquinoline-5-carboxylic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN=N2)N3CCC4=C(C=CC=C4C3)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN=N2)N3CCC4=C(C=CC=C4C3)C(=O)O)OC

InChI

InChI=1S/C20H19N3O4/c1-26-18-8-15-16(9-19(18)27-2)22-21-10-17(15)23-7-6-13-12(11-23)4-3-5-14(13)20(24)25/h3-5,8-10H,6-7,11H2,1-2H3,(H,24,25)