3-[4-(4-propylcyclohexyl)phenyl]prop-2-ynenitrile

Systemtic Name: 3-[4-(4-propylcyclohexyl)phenyl]prop-2-ynenitrile Openeye Name: 3-[4-(4-propylcyclohexyl)phenyl]prop-2-ynenitrile CAS Name: 3-[4-(4-propylcyclohexyl)phenyl]-2-propynenitrile IUPAC Name: 3-[4-(4-propylcyclohexyl)phenyl]prop-2-ynenitrile Traditional Name: 3-[4-(4-propylcyclohexyl)phenyl]propiolonitrile Formula: C18H21N MolecularWeight: 251.36604

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2=CC=C(C=C2)C#CC#N

Isomeric SMILES

CCCC1CCC(CC1)C2=CC=C(C=C2)C#CC#N

InChI

InChI=1S/C18H21N/c1-2-4-15-6-10-17(11-7-15)18-12-8-16(9-13-18)5-3-14-19/h8-9,12-13,15,17H,2,4,6-7,10-11H2,1H3