3-[5-(3-chlorophenyl)-2-(dimethylamino)-8-methoxy-quinazolin-7-yl]propanoic acid

Systemtic Name: 3-[5-(3-chlorophenyl)-2-(dimethylamino)-8-methoxy-quinazolin-7-yl]propanoic acid Openeye Name: 3-[5-(3-chlorophenyl)-2-(dimethylamino)-8-methoxy-quinazolin-7-yl]propanoic acid CAS Name: 3-[5-(3-chlorophenyl)-2-(dimethylamino)-8-methoxy-7-quinazolinyl]propanoic acid IUPAC Name: 3-[5-(3-chlorophenyl)-2-(dimethylamino)-8-methoxyquinazolin-7-yl]propanoic acid Traditional Name: 3-[5-(3-chlorophenyl)-2-(dimethylamino)-8-methoxy-quinazolin-7-yl]propionic acid Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C2C(=CC(=C(C2=N1)OC)CCC(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CN(C)C1=NC=C2C(=CC(=C(C2=N1)OC)CCC(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H20ClN3O3/c1-24(2)20-22-11-16-15(12-5-4-6-14(21)9-12)10-13(7-8-17(25)26)19(27-3)18(16)23-20/h4-6,9-11H,7-8H2,1-3H3,(H,25,26)