2-methyl-4-(1-oxidanylhexyl)benzenecarbonitrile

Systemtic Name: 2-methyl-4-(1-oxidanylhexyl)benzenecarbonitrile Openeye Name: 4-(1-hydroxyhexyl)-2-methyl-benzonitrile CAS Name: 4-(1-hydroxyhexyl)-2-methylbenzonitrile IUPAC Name: 4-(1-hydroxyhexyl)-2-methylbenzonitrile Traditional Name: 4-(1-hydroxyhexyl)-2-methyl-benzonitrile Formula: C14H19NO MolecularWeight: 217.30676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC(=C(C=C1)C#N)C)O

Isomeric SMILES

CCCCCC(C1=CC(=C(C=C1)C#N)C)O

InChI

InChI=1S/C14H19NO/c1-3-4-5-6-14(16)12-7-8-13(10-15)11(2)9-12/h7-9,14,16H,3-6H2,1-2H3