2-(4-butylphenyl)-6-nitro-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-(4-butylphenyl)-6-nitro-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(4-butylphenyl)-6-nitro-1,4-benzoquinone CAS Name: 2-(4-butylphenyl)-6-nitrocyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(4-butylphenyl)-6-nitrocyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(4-butylphenyl)-6-nitro-p-benzoquinone Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CC(=O)C=C(C2=O)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CC(=O)C=C(C2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4/c1-2-3-4-11-5-7-12(8-6-11)14-9-13(18)10-15(16(14)19)17(20)21/h5-10H,2-4H2,1H3