2-[4-[2-(3-nitrophenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-(3-nitrophenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-(3-nitrophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]phenoxy]acetic acid CAS Name: 2-[4-[2-(3-nitrophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-(3-nitrophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]phenoxy]acetic acid Traditional Name: 2-[4-[4-keto-2-(3-nitrophenyl)-1,2-dihydroquinazolin-3-yl]phenoxy]acetic acid Formula: C22H17N3O6 MolecularWeight: 419.38688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(N2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)OCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(N2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)OCC(=O)O

InChI

InChI=1S/C22H17N3O6/c26-20(27)13-31-17-10-8-15(9-11-17)24-21(14-4-3-5-16(12-14)25(29)30)23-19-7-2-1-6-18(19)22(24)28/h1-12,21,23H,13H2,(H,26,27)