diethyl 4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexane-1,1-dicarboxylate

Systemtic Name: diethyl 4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexane-1,1-dicarboxylate Openeye Name: diethyl 4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexane-1,1-dicarboxylate CAS Name: 4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexane-1,1-dicarboxylate Traditional Name: 4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexane-1,1-dicarboxylic acid diethyl ester Formula: C25H33NO6 MolecularWeight: 443.53262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(CC1)(C#N)C2=CC(=C(C=C2)OC)OC3CCCC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CCC(CC1)(C#N)C2=CC(=C(C=C2)OC)OC3CCCC3)C(=O)OCC

InChI

InChI=1S/C25H33NO6/c1-4-30-22(27)25(23(28)31-5-2)14-12-24(17-26,13-15-25)18-10-11-20(29-3)21(16-18)32-19-8-6-7-9-19/h10-11,16,19H,4-9,12-15H2,1-3H3