4-[1-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydroquinazolin-2-yl]benzoic acid

Systemtic Name: 4-[1-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydroquinazolin-2-yl]benzoic acid Openeye Name: 4-[1-(2-amino-2-oxo-ethyl)-4-oxo-2,3-dihydroquinazolin-2-yl]benzoic acid CAS Name: 4-[1-(2-amino-2-oxoethyl)-4-oxo-2,3-dihydroquinazolin-2-yl]benzoic acid IUPAC Name: 4-[1-(2-amino-2-oxoethyl)-4-oxo-2,3-dihydroquinazolin-2-yl]benzoic acid Traditional Name: 4-[1-(2-amino-2-keto-ethyl)-4-keto-2,3-dihydroquinazolin-2-yl]benzoic acid Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(N2CC(=O)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(N2CC(=O)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H15N3O4/c18-14(21)9-20-13-4-2-1-3-12(13)16(22)19-15(20)10-5-7-11(8-6-10)17(23)24/h1-8,15H,9H2,(H2,18,21)(H,19,22)(H,23,24)