tert-butyl 4-[4-cyano-4-(3-ethoxyphenyl)cyclohexyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-cyano-4-(3-ethoxyphenyl)cyclohexyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-cyano-4-(3-ethoxyphenyl)cyclohexyl]piperazine-1-carboxylate CAS Name: 4-[4-cyano-4-(3-ethoxyphenyl)cyclohexyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-cyano-4-(3-ethoxyphenyl)cyclohexyl]piperazine-1-carboxylate Traditional Name: 4-(4-cyano-4-m-phenetyl-cyclohexyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C24H35N3O3 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2(CCC(CC2)N3CCN(CC3)C(=O)OC(C)(C)C)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)C2(CCC(CC2)N3CCN(CC3)C(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C24H35N3O3/c1-5-29-21-8-6-7-19(17-21)24(18-25)11-9-20(10-12-24)26-13-15-27(16-14-26)22(28)30-23(2,3)4/h6-8,17,20H,5,9-16H2,1-4H3