4-[2-(dimethylamino)-8-methoxy-5-(3-nitrophenyl)quinazolin-7-yl]benzoic acid

Systemtic Name: 4-[2-(dimethylamino)-8-methoxy-5-(3-nitrophenyl)quinazolin-7-yl]benzoic acid Openeye Name: 4-[2-(dimethylamino)-8-methoxy-5-(3-nitrophenyl)quinazolin-7-yl]benzoic acid CAS Name: 4-[2-(dimethylamino)-8-methoxy-5-(3-nitrophenyl)-7-quinazolinyl]benzoic acid IUPAC Name: 4-[2-(dimethylamino)-8-methoxy-5-(3-nitrophenyl)quinazolin-7-yl]benzoic acid Traditional Name: 4-[2-(dimethylamino)-8-methoxy-5-(3-nitrophenyl)quinazolin-7-yl]benzoic acid Formula: C24H20N4O5 MolecularWeight: 444.4394

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C2C(=CC(=C(C2=N1)OC)C3=CC=C(C=C3)C(=O)O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=NC=C2C(=CC(=C(C2=N1)OC)C3=CC=C(C=C3)C(=O)O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O5/c1-27(2)24-25-13-20-18(16-5-4-6-17(11-16)28(31)32)12-19(22(33-3)21(20)26-24)14-7-9-15(10-8-14)23(29)30/h4-13H,1-3H3,(H,29,30)