[2,3-dicyano-4-(1-propyl-4-bicyclo[2.2.2]octanyl)phenyl] propanoate

Systemtic Name: [2,3-dicyano-4-(1-propyl-4-bicyclo[2.2.2]octanyl)phenyl] propanoate Openeye Name: [2,3-dicyano-4-(1-propyl-4-bicyclo[2.2.2]octanyl)phenyl] propanoate CAS Name: propanoic acid [2,3-dicyano-4-(1-propyl-4-bicyclo[2.2.2]octanyl)phenyl] ester IUPAC Name: [2,3-dicyano-4-(1-propyl-4-bicyclo[2.2.2]octanyl)phenyl] propanoate Traditional Name: propionic acid [2,3-dicyano-4-(1-propyl-4-bicyclo[2.2.2]octanyl)phenyl] ester Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12CCC(CC1)(CC2)C3=C(C(=C(C=C3)OC(=O)CC)C#N)C#N

Isomeric SMILES

CCCC12CCC(CC1)(CC2)C3=C(C(=C(C=C3)OC(=O)CC)C#N)C#N

InChI

InChI=1S/C22H26N2O2/c1-3-7-21-8-11-22(12-9-21,13-10-21)18-5-6-19(26-20(25)4-2)17(15-24)16(18)14-23/h5-6H,3-4,7-13H2,1-2H3