2-[4-[[(2-oxidanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[(2-oxidanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[(2-oxo-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[(2-oxo-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[(2-oxo-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[(2-keto-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)CNC3=NC(=O)NC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CNC3=NC(=O)NC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C22H17N3O3/c26-21(27)17-6-2-1-5-16(17)15-11-9-14(10-12-15)13-23-20-18-7-3-4-8-19(18)24-22(28)25-20/h1-12H,13H2,(H,26,27)(H2,23,24,25,28)