4-(4-methyl-2-nitro-phenyl)benzoic acid

Systemtic Name: 4-(4-methyl-2-nitro-phenyl)benzoic acid Openeye Name: 4-(4-methyl-2-nitro-phenyl)benzoic acid CAS Name: 4-(4-methyl-2-nitrophenyl)benzoic acid IUPAC Name: 4-(4-methyl-2-nitrophenyl)benzoic acid Traditional Name: 4-(4-methyl-2-nitro-phenyl)benzoic acid Formula: C14H11NO4 MolecularWeight: 257.24144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO4/c1-9-2-7-12(13(8-9)15(18)19)10-3-5-11(6-4-10)14(16)17/h2-8H,1H3,(H,16,17)