3-methyl-5-nitro-4-oxidanyl-benzaldehyde

Systemtic Name: 3-methyl-5-nitro-4-oxidanyl-benzaldehyde Openeye Name: 4-hydroxy-3-methyl-5-nitro-benzaldehyde CAS Name: 4-hydroxy-3-methyl-5-nitrobenzaldehyde IUPAC Name: 4-hydroxy-3-methyl-5-nitrobenzaldehyde Traditional Name: 4-hydroxy-3-methyl-5-nitro-benzaldehyde Formula: C8H7NO4 MolecularWeight: 181.14548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7NO4/c1-5-2-6(4-10)3-7(8(5)11)9(12)13/h2-4,11H,1H3