2-nitro-6-[(4-phenylmethoxyphenyl)carbamoyl]benzoic acid

Systemtic Name: 2-nitro-6-[(4-phenylmethoxyphenyl)carbamoyl]benzoic acid Openeye Name: 2-[(4-benzyloxyphenyl)carbamoyl]-6-nitro-benzoic acid CAS Name: 2-nitro-6-[oxo-(4-phenylmethoxyanilino)methyl]benzoic acid IUPAC Name: 2-nitro-6-[(4-phenylmethoxyphenyl)carbamoyl]benzoic acid Traditional Name: 2-[(4-benzoxyphenyl)carbamoyl]-6-nitro-benzoic acid Formula: C21H16N2O6 MolecularWeight: 392.36154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C21H16N2O6/c24-20(17-7-4-8-18(23(27)28)19(17)21(25)26)22-15-9-11-16(12-10-15)29-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)(H,25,26)