2-(2,2-diphenylethylamino)-5-nitro-benzoic acid

Systemtic Name: 2-(2,2-diphenylethylamino)-5-nitro-benzoic acid Openeye Name: 2-(2,2-diphenylethylamino)-5-nitro-benzoic acid CAS Name: 2-(2,2-diphenylethylamino)-5-nitrobenzoic acid IUPAC Name: 2-(2,2-diphenylethylamino)-5-nitrobenzoic acid Traditional Name: 2-(2,2-diphenylethylamino)-5-nitro-benzoic acid Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O4/c24-21(25)18-13-17(23(26)27)11-12-20(18)22-14-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,19,22H,14H2,(H,24,25)