(E)-3-[4-[(4-pentylphenyl)methoxy]cyclohexyl]prop-2-enenitrile

Systemtic Name: (E)-3-[4-[(4-pentylphenyl)methoxy]cyclohexyl]prop-2-enenitrile Openeye Name: (E)-3-[4-[(4-pentylphenyl)methoxy]cyclohexyl]prop-2-enenitrile CAS Name: (E)-3-[4-[(4-pentylphenyl)methoxy]cyclohexyl]-2-propenenitrile IUPAC Name: (E)-3-[4-[(4-pentylphenyl)methoxy]cyclohexyl]prop-2-enenitrile Traditional Name: (E)-3-[4-(4-amylbenzyl)oxycyclohexyl]acrylonitrile Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)COC2CCC(CC2)C=CC#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)COC2CCC(CC2)/C=C/C#N

InChI

InChI=1S/C21H29NO/c1-2-3-4-6-18-8-10-20(11-9-18)17-23-21-14-12-19(13-15-21)7-5-16-22/h5,7-11,19,21H,2-4,6,12-15,17H2,1H3/b7-5+