4-[8-methoxy-2-(methylamino)-5-pyridin-4-yl-quinazolin-7-yl]benzoic acid

Systemtic Name: 4-[8-methoxy-2-(methylamino)-5-pyridin-4-yl-quinazolin-7-yl]benzoic acid Openeye Name: 4-[8-methoxy-2-(methylamino)-5-(4-pyridyl)quinazolin-7-yl]benzoic acid CAS Name: 4-[8-methoxy-2-(methylamino)-5-pyridin-4-yl-7-quinazolinyl]benzoic acid IUPAC Name: 4-[8-methoxy-2-(methylamino)-5-pyridin-4-ylquinazolin-7-yl]benzoic acid Traditional Name: 4-[8-methoxy-2-(methylamino)-5-(4-pyridyl)quinazolin-7-yl]benzoic acid Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C2C(=CC(=C(C2=N1)OC)C3=CC=C(C=C3)C(=O)O)C4=CC=NC=C4

Isomeric SMILES

CNC1=NC=C2C(=CC(=C(C2=N1)OC)C3=CC=C(C=C3)C(=O)O)C4=CC=NC=C4

InChI

InChI=1S/C22H18N4O3/c1-23-22-25-12-18-16(14-7-9-24-10-8-14)11-17(20(29-2)19(18)26-22)13-3-5-15(6-4-13)21(27)28/h3-12H,1-2H3,(H,27,28)(H,23,25,26)