3-chloranyl-2,4-dimethyl-5-nitro-6-oxidanyl-benzaldehyde

Systemtic Name: 3-chloranyl-2,4-dimethyl-5-nitro-6-oxidanyl-benzaldehyde Openeye Name: 5-chloro-2-hydroxy-4,6-dimethyl-3-nitro-benzaldehyde CAS Name: 5-chloro-2-hydroxy-4,6-dimethyl-3-nitrobenzaldehyde IUPAC Name: 5-chloro-2-hydroxy-4,6-dimethyl-3-nitrobenzaldehyde Traditional Name: 5-chloro-2-hydroxy-4,6-dimethyl-3-nitro-benzaldehyde Formula: C9H8ClNO4 MolecularWeight: 229.61712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8ClNO4/c1-4-6(3-12)9(13)8(11(14)15)5(2)7(4)10/h3,13H,1-2H3