3-chloranyl-4-methyl-5-nitro-benzoic acid

Systemtic Name: 3-chloranyl-4-methyl-5-nitro-benzoic acid Openeye Name: 3-chloro-4-methyl-5-nitro-benzoic acid CAS Name: 3-chloro-4-methyl-5-nitrobenzoic acid IUPAC Name: 3-chloro-4-methyl-5-nitrobenzoic acid Traditional Name: 3-chloro-4-methyl-5-nitro-benzoic acid Formula: C8H6ClNO4 MolecularWeight: 215.59054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1Cl)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H6ClNO4/c1-4-6(9)2-5(8(11)12)3-7(4)10(13)14/h2-3H,1H3,(H,11,12)