4-[4-methoxy-3-(3-nitrophenyl)phenyl]-2-methyl-benzoic acid

Systemtic Name: 4-[4-methoxy-3-(3-nitrophenyl)phenyl]-2-methyl-benzoic acid Openeye Name: 4-[4-methoxy-3-(3-nitrophenyl)phenyl]-2-methyl-benzoic acid CAS Name: 4-[4-methoxy-3-(3-nitrophenyl)phenyl]-2-methylbenzoic acid IUPAC Name: 4-[4-methoxy-3-(3-nitrophenyl)phenyl]-2-methylbenzoic acid Traditional Name: 4-[4-methoxy-3-(3-nitrophenyl)phenyl]-2-methyl-benzoic acid Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

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