(4-propylcyclohexyl) 2,3-dicyano-4-pentyl-benzoate

Systemtic Name: (4-propylcyclohexyl) 2,3-dicyano-4-pentyl-benzoate Openeye Name: (4-propylcyclohexyl) 2,3-dicyano-4-pentyl-benzoate CAS Name: 2,3-dicyano-4-pentylbenzoic acid (4-propylcyclohexyl) ester IUPAC Name: (4-propylcyclohexyl) 2,3-dicyano-4-pentylbenzoate Traditional Name: 4-amyl-2,3-dicyano-benzoic acid (4-propylcyclohexyl) ester Formula: C23H30N2O2 MolecularWeight: 366.4965

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1)C(=O)OC2CCC(CC2)CCC)C#N)C#N

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1)C(=O)OC2CCC(CC2)CCC)C#N)C#N

InChI

InChI=1S/C23H30N2O2/c1-3-5-6-8-18-11-14-20(22(16-25)21(18)15-24)23(26)27-19-12-9-17(7-4-2)10-13-19/h11,14,17,19H,3-10,12-13H2,1-2H3