(2,3-dicyano-4-pentoxy-phenyl) 4-(4-propylcyclohexyl)benzoate

Systemtic Name: (2,3-dicyano-4-pentoxy-phenyl) 4-(4-propylcyclohexyl)benzoate Openeye Name: (2,3-dicyano-4-pentoxy-phenyl) 4-(4-propylcyclohexyl)benzoate CAS Name: 4-(4-propylcyclohexyl)benzoic acid (2,3-dicyano-4-pentoxyphenyl) ester IUPAC Name: (2,3-dicyano-4-pentoxyphenyl) 4-(4-propylcyclohexyl)benzoate Traditional Name: 4-(4-propylcyclohexyl)benzoic acid (4-amoxy-2,3-dicyano-phenyl) ester Formula: C29H34N2O3 MolecularWeight: 458.59186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3)CCC)C#N)C#N

Isomeric SMILES

CCCCCOC1=C(C(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3)CCC)C#N)C#N

InChI

InChI=1S/C29H34N2O3/c1-3-5-6-18-33-27-16-17-28(26(20-31)25(27)19-30)34-29(32)24-14-12-23(13-15-24)22-10-8-21(7-4-2)9-11-22/h12-17,21-22H,3-11,18H2,1-2H3