4-[(5-nitro-2-phenylmethoxy-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5-nitro-2-phenylmethoxy-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-benzyloxy-5-nitro-anilino)-4-oxo-butanoic acid CAS Name: 4-(5-nitro-2-phenylmethoxyanilino)-4-oxobutanoic acid IUPAC Name: 4-(5-nitro-2-phenylmethoxyanilino)-4-oxobutanoic acid Traditional Name: 4-(2-benzoxy-5-nitro-anilino)-4-keto-butyric acid Formula: C17H16N2O6 MolecularWeight: 344.31874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)CCC(=O)O

InChI

InChI=1S/C17H16N2O6/c20-16(8-9-17(21)22)18-14-10-13(19(23)24)6-7-15(14)25-11-12-4-2-1-3-5-12/h1-7,10H,8-9,11H2,(H,18,20)(H,21,22)