5-chloranyl-2-methoxy-4-[(2-propan-2-ylquinazolin-4-yl)amino]benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-[(2-propan-2-ylquinazolin-4-yl)amino]benzoic acid Openeye Name: 5-chloro-4-[(2-isopropylquinazolin-4-yl)amino]-2-methoxy-benzoic acid CAS Name: 5-chloro-2-methoxy-4-[(2-propan-2-yl-4-quinazolinyl)amino]benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-[(2-propan-2-ylquinazolin-4-yl)amino]benzoic acid Traditional Name: 5-chloro-4-[(2-isopropylquinazolin-4-yl)amino]-2-methoxy-benzoic acid Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)NC3=C(C=C(C(=C3)OC)C(=O)O)Cl

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)NC3=C(C=C(C(=C3)OC)C(=O)O)Cl

InChI

InChI=1S/C19H18ClN3O3/c1-10(2)17-21-14-7-5-4-6-11(14)18(23-17)22-15-9-16(26-3)12(19(24)25)8-13(15)20/h4-10H,1-3H3,(H,24,25)(H,21,22,23)