2-[4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-(3-nitroanilino)-2-oxo-ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-(3-nitroanilino)-2-oxoethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-(3-nitroanilino)-2-oxoethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-keto-2-(3-nitroanilino)ethyl]phenoxy]acetic acid Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CC2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CC2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C16H14N2O6/c19-15(17-12-2-1-3-13(9-12)18(22)23)8-11-4-6-14(7-5-11)24-10-16(20)21/h1-7,9H,8,10H2,(H,17,19)(H,20,21)