2-chloranyl-4,5-dimethyl-3-nitro-benzoic acid

Systemtic Name: 2-chloranyl-4,5-dimethyl-3-nitro-benzoic acid Openeye Name: 2-chloro-4,5-dimethyl-3-nitro-benzoic acid CAS Name: 2-chloro-4,5-dimethyl-3-nitrobenzoic acid IUPAC Name: 2-chloro-4,5-dimethyl-3-nitrobenzoic acid Traditional Name: 2-chloro-4,5-dimethyl-3-nitro-benzoic acid Formula: C9H8ClNO4 MolecularWeight: 229.61712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8ClNO4/c1-4-3-6(9(12)13)7(10)8(5(4)2)11(14)15/h3H,1-2H3,(H,12,13)