2-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-4-bromanyl-6-nitro-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-4-bromanyl-6-nitro-phenoxy]ethanoic acid Openeye Name: 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-nitro-phenoxy]acetic acid CAS Name: 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-nitrophenoxy]acetic acid IUPAC Name: 2-[4-bromo-2-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-6-nitrophenoxy]acetic acid Traditional Name: 2-[4-bromo-2-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-6-nitro-phenoxy]acetic acid Formula: C17H11BrN4O7 MolecularWeight: 463.19584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=CC(=CC(=C3OCC(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=CC(=CC(=C3OCC(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C17H11BrN4O7/c18-10-5-9(15(29-8-14(23)24)13(6-10)22(27)28)7-19-21-16(25)11-3-1-2-4-12(11)20-17(21)26/h1-7H,8H2,(H,20,26)(H,23,24)