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

Systemtic Name: (2,3-dicyano-4-pentoxy-phenyl) 4-butylcyclohexane-1-carboxylate Openeye Name: (2,3-dicyano-4-pentoxy-phenyl) 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid (2,3-dicyano-4-pentoxyphenyl) ester IUPAC Name: (2,3-dicyano-4-pentoxyphenyl) 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid (4-amoxy-2,3-dicyano-phenyl) ester Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O3/c1-3-5-7-15-28-22-13-14-23(21(17-26)20(22)16-25)29-24(27)19-11-9-18(10-12-19)8-6-4-2/h13-14,18-19H,3-12,15H2,1-2H3