(2,3-dicyano-4-pentoxy-phenyl) 4-propylcyclohexane-1-carboxylate

Systemtic Name: (2,3-dicyano-4-pentoxy-phenyl) 4-propylcyclohexane-1-carboxylate Openeye Name: (2,3-dicyano-4-pentoxy-phenyl) 4-propylcyclohexanecarboxylate CAS Name: 4-propyl-1-cyclohexanecarboxylic acid (2,3-dicyano-4-pentoxyphenyl) ester IUPAC Name: (2,3-dicyano-4-pentoxyphenyl) 4-propylcyclohexane-1-carboxylate Traditional Name: 4-propylcyclohexanecarboxylic acid (4-amoxy-2,3-dicyano-phenyl) ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)CCC)C#N)C#N

Isomeric SMILES

CCCCCOC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)CCC)C#N)C#N

InChI

InChI=1S/C23H30N2O3/c1-3-5-6-14-27-21-12-13-22(20(16-25)19(21)15-24)28-23(26)18-10-8-17(7-4-2)9-11-18/h12-13,17-18H,3-11,14H2,1-2H3