6-(2-methoxy-5-methyl-phenyl)-2-methyl-3-nitro-benzoic acid

Systemtic Name: 6-(2-methoxy-5-methyl-phenyl)-2-methyl-3-nitro-benzoic acid Openeye Name: 6-(2-methoxy-5-methyl-phenyl)-2-methyl-3-nitro-benzoic acid CAS Name: 6-(2-methoxy-5-methylphenyl)-2-methyl-3-nitrobenzoic acid IUPAC Name: 6-(2-methoxy-5-methylphenyl)-2-methyl-3-nitrobenzoic acid Traditional Name: 6-(2-methoxy-5-methyl-phenyl)-2-methyl-3-nitro-benzoic acid Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO5/c1-9-4-7-14(22-3)12(8-9)11-5-6-13(17(20)21)10(2)15(11)16(18)19/h4-8H,1-3H3,(H,18,19)