8-(4-methylphenyl)octadecanenitrile; 9-(4-methylphenyl)octadecanenitrile; 10-(4-methylphenyl)octadecanenitrile; 11-(4-methylphenyl)octadecanenitrile

Systemtic Name: 8-(4-methylphenyl)octadecanenitrile; 9-(4-methylphenyl)octadecanenitrile; 10-(4-methylphenyl)octadecanenitrile; 11-(4-methylphenyl)octadecanenitrile Openeye Name: 8-(p-tolyl)octadecanenitrile; 9-(p-tolyl)octadecanenitrile; 10-(p-tolyl)octadecanenitrile; 11-(p-tolyl)octadecanenitrile CAS Name: 8-(4-methylphenyl)octadecanenitrile; 9-(4-methylphenyl)octadecanenitrile; 10-(4-methylphenyl)octadecanenitrile; 11-(4-methylphenyl)octadecanenitrile IUPAC Name: 8-(4-methylphenyl)octadecanenitrile; 9-(4-methylphenyl)octadecanenitrile; 10-(4-methylphenyl)octadecanenitrile; 11-(4-methylphenyl)octadecanenitrile Traditional Name: 8-(p-tolyl)stearonitrile; 9-(p-tolyl)stearonitrile; 10-(p-tolyl)stearonitrile; 11-(p-tolyl)stearonitrile Formula: C100H164N4 MolecularWeight: 1422.39896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCC#N)C1=CC=C(C=C1)C.CCCCCCCCCC(CCCCCCCC#N)C1=CC=C(C=C1)C.CCCCCCCCC(CCCCCCCCC#N)C1=CC=C(C=C1)C.CCCCCCCC(CCCCCCCCCC#N)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCCCC(CCCCCCC#N)C1=CC=C(C=C1)C.CCCCCCCCCC(CCCCCCCC#N)C1=CC=C(C=C1)C.CCCCCCCCC(CCCCCCCCC#N)C1=CC=C(C=C1)C.CCCCCCCC(CCCCCCCCCC#N)C1=CC=C(C=C1)C

InChI

InChI=1S/4C25H41N/c1-3-4-5-10-13-16-24(25-20-18-23(2)19-21-25)17-14-11-8-6-7-9-12-15-22-26;1-3-4-5-6-10-13-16-24(25-20-18-23(2)19-21-25)17-14-11-8-7-9-12-15-22-26;1-3-4-5-6-7-10-13-16-24(25-20-18-23(2)19-21-25)17-14-11-8-9-12-15-22-26;1-3-4-5-6-7-8-10-13-16-24(17-14-11-9-12-15-22-26)25-20-18-23(2)19-21-25/h4*18-21,24H,3-17H2,1-2H3