(4-dodecylphenyl)-(3-methyl-5-nitro-2-oxidanyl-phenyl)methanone

Systemtic Name: (4-dodecylphenyl)-(3-methyl-5-nitro-2-oxidanyl-phenyl)methanone Openeye Name: (4-dodecylphenyl)-(2-hydroxy-3-methyl-5-nitro-phenyl)methanone CAS Name: (4-dodecylphenyl)-(2-hydroxy-3-methyl-5-nitrophenyl)methanone IUPAC Name: (4-dodecylphenyl)-(2-hydroxy-3-methyl-5-nitrophenyl)methanone Traditional Name: (2-hydroxy-3-methyl-5-nitro-phenyl)-(4-laurylphenyl)methanone Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2O)C)[N+](=O)[O-]

InChI

InChI=1S/C26H35NO4/c1-3-4-5-6-7-8-9-10-11-12-13-21-14-16-22(17-15-21)26(29)24-19-23(27(30)31)18-20(2)25(24)28/h14-19,28H,3-13H2,1-2H3