4-[[2-(dimethylaminomethyl)quinazolin-4-yl]amino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[[2-(dimethylaminomethyl)quinazolin-4-yl]amino]-2-oxidanyl-benzoic acid Openeye Name: 4-[[2-(dimethylaminomethyl)quinazolin-4-yl]amino]-2-hydroxy-benzoic acid CAS Name: 4-[[2-(dimethylaminomethyl)-4-quinazolinyl]amino]-2-hydroxybenzoic acid IUPAC Name: 4-[[2-(dimethylaminomethyl)quinazolin-4-yl]amino]-2-hydroxybenzoic acid Traditional Name: 4-[[2-(dimethylaminomethyl)quinazolin-4-yl]amino]-2-hydroxy-benzoic acid Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)C(=O)O)O

Isomeric SMILES

CN(C)CC1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)C(=O)O)O

InChI

InChI=1S/C18H18N4O3/c1-22(2)10-16-20-14-6-4-3-5-12(14)17(21-16)19-11-7-8-13(18(24)25)15(23)9-11/h3-9,23H,10H2,1-2H3,(H,24,25)(H,19,20,21)