3-[(4-oxidanylidene-1-prop-2-enyl-quinazolin-2-yl)amino]benzoic acid

Systemtic Name: 3-[(4-oxidanylidene-1-prop-2-enyl-quinazolin-2-yl)amino]benzoic acid Openeye Name: 3-[(1-allyl-4-oxo-quinazolin-2-yl)amino]benzoic acid CAS Name: 3-[(4-oxo-1-prop-2-enyl-2-quinazolinyl)amino]benzoic acid IUPAC Name: 3-[(4-oxo-1-prop-2-enylquinazolin-2-yl)amino]benzoic acid Traditional Name: 3-[(1-allyl-4-keto-quinazolin-2-yl)amino]benzoic acid Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2C(=O)N=C1NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C=CCN1C2=CC=CC=C2C(=O)N=C1NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C18H15N3O3/c1-2-10-21-15-9-4-3-8-14(15)16(22)20-18(21)19-13-7-5-6-12(11-13)17(23)24/h2-9,11H,1,10H2,(H,23,24)(H,19,20,22)