2-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-4-nitro-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-4-nitro-phenoxy]ethanoic acid Openeye Name: 2-[2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-4-nitro-phenoxy]acetic acid CAS Name: 2-[2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-4-nitrophenoxy]acetic acid IUPAC Name: 2-[2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-4-nitrophenoxy]acetic acid Traditional Name: 2-[2-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-4-nitro-phenoxy]acetic acid Formula: C17H12N4O7 MolecularWeight: 384.29978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])OCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])OCC(=O)O

InChI

InChI=1S/C17H12N4O7/c22-15(23)9-28-14-6-5-11(21(26)27)7-10(14)8-18-20-16(24)12-3-1-2-4-13(12)19-17(20)25/h1-8H,9H2,(H,19,25)(H,22,23)