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

Systemtic Name: 4-[5-(3-chlorophenyl)-2-(ethylamino)-8-methoxy-quinazolin-7-yl]benzoic acid Openeye Name: 4-[5-(3-chlorophenyl)-2-(ethylamino)-8-methoxy-quinazolin-7-yl]benzoic acid CAS Name: 4-[5-(3-chlorophenyl)-2-(ethylamino)-8-methoxy-7-quinazolinyl]benzoic acid IUPAC Name: 4-[5-(3-chlorophenyl)-2-(ethylamino)-8-methoxyquinazolin-7-yl]benzoic acid Traditional Name: 4-[5-(3-chlorophenyl)-2-(ethylamino)-8-methoxy-quinazolin-7-yl]benzoic acid Formula: C24H20ClN3O3 MolecularWeight: 433.8869

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=C2C(=CC(=C(C2=N1)OC)C3=CC=C(C=C3)C(=O)O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCNC1=NC=C2C(=CC(=C(C2=N1)OC)C3=CC=C(C=C3)C(=O)O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H20ClN3O3/c1-3-26-24-27-13-20-18(16-5-4-6-17(25)11-16)12-19(22(31-2)21(20)28-24)14-7-9-15(10-8-14)23(29)30/h4-13H,3H2,1-2H3,(H,29,30)(H,26,27,28)