(4-dodecylphenyl)-(5-nitro-2-oxidanyl-phenyl)methanone

Systemtic Name: (4-dodecylphenyl)-(5-nitro-2-oxidanyl-phenyl)methanone Openeye Name: (4-dodecylphenyl)-(2-hydroxy-5-nitro-phenyl)methanone CAS Name: (4-dodecylphenyl)-(2-hydroxy-5-nitrophenyl)methanone IUPAC Name: (4-dodecylphenyl)-(2-hydroxy-5-nitrophenyl)methanone Traditional Name: (2-hydroxy-5-nitro-phenyl)-(4-laurylphenyl)methanone Formula: C25H33NO4 MolecularWeight: 411.53382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C25H33NO4/c1-2-3-4-5-6-7-8-9-10-11-12-20-13-15-21(16-14-20)25(28)23-19-22(26(29)30)17-18-24(23)27/h13-19,27H,2-12H2,1H3