[2-(4-cyanophenyl)phenyl] 4-(3-methylidenepentyl)cyclohexane-1-carboxylate

Systemtic Name: [2-(4-cyanophenyl)phenyl] 4-(3-methylidenepentyl)cyclohexane-1-carboxylate Openeye Name: [2-(4-cyanophenyl)phenyl] 4-(3-methylenepentyl)cyclohexanecarboxylate CAS Name: 4-(3-methylenepentyl)-1-cyclohexanecarboxylic acid [2-(4-cyanophenyl)phenyl] ester IUPAC Name: [2-(4-cyanophenyl)phenyl] 4-(3-methylidenepentyl)cyclohexane-1-carboxylate Traditional Name: 4-(3-ethylbut-3-enyl)cyclohexanecarboxylic acid [2-(4-cyanophenyl)phenyl] ester Formula: C26H29NO2 MolecularWeight: 387.51396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)CCC1CCC(CC1)C(=O)OC2=CC=CC=C2C3=CC=C(C=C3)C#N

Isomeric SMILES

CCC(=C)CCC1CCC(CC1)C(=O)OC2=CC=CC=C2C3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H29NO2/c1-3-19(2)8-9-20-10-16-23(17-11-20)26(28)29-25-7-5-4-6-24(25)22-14-12-21(18-27)13-15-22/h4-7,12-15,20,23H,2-3,8-11,16-17H2,1H3