3,3-dimethyl-1-quinolin-3-yl-4H-isoquinoline-5-carboxylic acid

Systemtic Name: 3,3-dimethyl-1-quinolin-3-yl-4H-isoquinoline-5-carboxylic acid Openeye Name: 3,3-dimethyl-1-(3-quinolyl)-4H-isoquinoline-5-carboxylic acid CAS Name: 3,3-dimethyl-1-(3-quinolinyl)-4H-isoquinoline-5-carboxylic acid IUPAC Name: 3,3-dimethyl-1-quinolin-3-yl-4H-isoquinoline-5-carboxylic acid Traditional Name: 3,3-dimethyl-1-(3-quinolyl)-4H-isoquinoline-5-carboxylic acid Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC=C2C(=O)O)C(=N1)C3=CC4=CC=CC=C4N=C3)C

Isomeric SMILES

CC1(CC2=C(C=CC=C2C(=O)O)C(=N1)C3=CC4=CC=CC=C4N=C3)C

InChI

InChI=1S/C21H18N2O2/c1-21(2)11-17-15(7-5-8-16(17)20(24)25)19(23-21)14-10-13-6-3-4-9-18(13)22-12-14/h3-10,12H,11H2,1-2H3,(H,24,25)