4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl]benzoic acid

Systemtic Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl]benzoic acid Openeye Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-7-oxo-pyrido[2,3-d]pyrimidin-8-yl]benzoic acid CAS Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-7-oxo-8-pyrido[2,3-d]pyrimidinyl]benzoic acid IUPAC Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-7-oxopyrido[2,3-d]pyrimidin-8-yl]benzoic acid Traditional Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-keto-4-methyl-pyrido[2,3-d]pyrimidin-8-yl]benzoic acid Formula: C24H20N4O3 MolecularWeight: 412.4406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCC4=CC=CC=C4C3)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCC4=CC=CC=C4C3)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C24H20N4O3/c1-15-20-10-11-21(29)28(19-8-6-17(7-9-19)23(30)31)22(20)26-24(25-15)27-13-12-16-4-2-3-5-18(16)14-27/h2-11H,12-14H2,1H3,(H,30,31)