3-[4-(2,6-dimethoxyphenyl)phenyl]-2-[(2-nitrophenyl)amino]propanoic acid

Systemtic Name: 3-[4-(2,6-dimethoxyphenyl)phenyl]-2-[(2-nitrophenyl)amino]propanoic acid Openeye Name: 3-[4-(2,6-dimethoxyphenyl)phenyl]-2-(2-nitroanilino)propanoic acid CAS Name: 3-[4-(2,6-dimethoxyphenyl)phenyl]-2-(2-nitroanilino)propanoic acid IUPAC Name: 3-[4-(2,6-dimethoxyphenyl)phenyl]-2-(2-nitroanilino)propanoic acid Traditional Name: 3-[4-(2,6-dimethoxyphenyl)phenyl]-2-(2-nitroanilino)propionic acid Formula: C23H22N2O6 MolecularWeight: 422.43058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H22N2O6/c1-30-20-8-5-9-21(31-2)22(20)16-12-10-15(11-13-16)14-18(23(26)27)24-17-6-3-4-7-19(17)25(28)29/h3-13,18,24H,14H2,1-2H3,(H,26,27)