4-[(E)-pent-1-enyl]-2-[4-(4-propylcyclohexen-1-yl)phenyl]benzoate

Systemtic Name: 4-[(E)-pent-1-enyl]-2-[4-(4-propylcyclohexen-1-yl)phenyl]benzoate Openeye Name: 4-[(E)-pent-1-enyl]-2-[4-(4-propylcyclohexen-1-yl)phenyl]benzoate CAS Name: 4-[(E)-pent-1-enyl]-2-[4-(4-propyl-1-cyclohexenyl)phenyl]benzoate IUPAC Name: 4-[(E)-pent-1-enyl]-2-[4-(4-propylcyclohexen-1-yl)phenyl]benzoate Traditional Name: 4-[(E)-pent-1-enyl]-2-[4-(4-propylcyclohexen-1-yl)phenyl]benzoate Formula: C27H31O2- MolecularWeight: 387.53384

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1=CC(=C(C=C1)C(=O)[O-])C2=CC=C(C=C2)C3=CCC(CC3)CCC

Isomeric SMILES

CCC/C=C/C1=CC(=C(C=C1)C(=O)[O-])C2=CC=C(C=C2)C3=CCC(CC3)CCC

InChI

InChI=1S/C27H32O2/c1-3-5-6-8-21-11-18-25(27(28)29)26(19-21)24-16-14-23(15-17-24)22-12-9-20(7-4-2)10-13-22/h6,8,11-12,14-20H,3-5,7,9-10,13H2,1-2H3,(H,28,29)/p-1/b8-6+