[4-(4-butylcyclohexyl)carbonyloxy-2,3-dicyano-phenyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [4-(4-butylcyclohexyl)carbonyloxy-2,3-dicyano-phenyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [4-(4-butylcyclohexanecarbonyl)oxy-2,3-dicyano-phenyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [4-[(4-butylcyclohexyl)-oxomethoxy]-2,3-dicyanophenyl] ester IUPAC Name: [4-(4-butylcyclohexanecarbonyl)oxy-2,3-dicyanophenyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [4-(4-butylcyclohexanecarbonyl)oxy-2,3-dicyano-phenyl] ester Formula: C30H40N2O4 MolecularWeight: 492.6496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OC(=O)C3CCC(CC3)CCCC)C#N)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OC(=O)C3CCC(CC3)CCCC)C#N)C#N

InChI

InChI=1S/C30H40N2O4/c1-3-5-7-21-9-13-23(14-10-21)29(33)35-27-17-18-28(26(20-32)25(27)19-31)36-30(34)24-15-11-22(12-16-24)8-6-4-2/h17-18,21-24H,3-16H2,1-2H3