3-[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-6-yl]propanoic acid

Systemtic Name: 3-[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-6-yl]propanoic acid Openeye Name: 3-[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-6-yl]propanoic acid CAS Name: 3-[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)-6-quinazolinyl]propanoic acid IUPAC Name: 3-[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-6-yl]propanoic acid Traditional Name: 3-[5-(3-chlorophenyl)-8-methoxy-2-(methylamino)quinazolin-6-yl]propionic acid Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=C(C(=C2C=N1)C3=CC(=CC=C3)Cl)CCC(=O)O)OC

Isomeric SMILES

CNC1=NC2=C(C=C(C(=C2C=N1)C3=CC(=CC=C3)Cl)CCC(=O)O)OC

InChI

InChI=1S/C19H18ClN3O3/c1-21-19-22-10-14-17(11-4-3-5-13(20)8-11)12(6-7-16(24)25)9-15(26-2)18(14)23-19/h3-5,8-10H,6-7H2,1-2H3,(H,24,25)(H,21,22,23)