5-dodecyl-2-phenyl-benzenecarbonitrile oxide

Systemtic Name: 5-dodecyl-2-phenyl-benzenecarbonitrile oxide Openeye Name: 5-dodecyl-2-phenyl-benzonitrile oxide CAS Name: 5-dodecyl-2-phenylbenzonitrile oxide IUPAC Name: 5-dodecyl-2-phenylbenzonitrile oxide Traditional Name: 5-lauryl-2-phenyl-benzonitrile oxide Formula: C25H33NO MolecularWeight: 363.53562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO/c1-2-3-4-5-6-7-8-9-10-12-15-22-18-19-25(24(20-22)21-26-27)23-16-13-11-14-17-23/h11,13-14,16-20H,2-10,12,15H2,1H3