3-(2-ethylphenoxy)-5-nitro-4-phenyl-benzoic acid

Systemtic Name: 3-(2-ethylphenoxy)-5-nitro-4-phenyl-benzoic acid Openeye Name: 3-(2-ethylphenoxy)-5-nitro-4-phenyl-benzoic acid CAS Name: 3-(2-ethylphenoxy)-5-nitro-4-phenylbenzoic acid IUPAC Name: 3-(2-ethylphenoxy)-5-nitro-4-phenylbenzoic acid Traditional Name: 3-(2-ethylphenoxy)-5-nitro-4-phenyl-benzoic acid Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1OC2=CC(=CC(=C2C3=CC=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCC1=CC=CC=C1OC2=CC(=CC(=C2C3=CC=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C21H17NO5/c1-2-14-8-6-7-11-18(14)27-19-13-16(21(23)24)12-17(22(25)26)20(19)15-9-4-3-5-10-15/h3-13H,2H2,1H3,(H,23,24)