3-nitro-4-(phenylcarbonyl)-5-phenylmethoxy-benzoic acid

Systemtic Name: 3-nitro-4-(phenylcarbonyl)-5-phenylmethoxy-benzoic acid Openeye Name: 4-benzoyl-3-benzyloxy-5-nitro-benzoic acid CAS Name: 4-benzoyl-3-nitro-5-phenylmethoxybenzoic acid IUPAC Name: 4-benzoyl-3-nitro-5-phenylmethoxybenzoic acid Traditional Name: 3-benzoxy-4-benzoyl-5-nitro-benzoic acid Formula: C21H15NO6 MolecularWeight: 377.3469

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=CC(=C2C(=O)C3=CC=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=CC(=C2C(=O)C3=CC=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C21H15NO6/c23-20(15-9-5-2-6-10-15)19-17(22(26)27)11-16(21(24)25)12-18(19)28-13-14-7-3-1-4-8-14/h1-12H,13H2,(H,24,25)