tert-butyl 3-[[1-[(4-cyanophenyl)methyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[1-[(4-cyanophenyl)methyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[1-[(4-cyanophenyl)methyl]-3-piperidyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[1-[(4-cyanophenyl)methyl]-3-piperidinyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[1-[(4-cyanophenyl)methyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[1-(4-cyanobenzyl)-3-piperidyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H34N4O3 MolecularWeight: 426.55176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC2CCCN(C2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC2CCCN(C2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H34N4O3/c1-24(2,3)31-23(30)28-13-4-6-20(16-28)22(29)26-21-7-5-12-27(17-21)15-19-10-8-18(14-25)9-11-19/h8-11,20-21H,4-7,12-13,15-17H2,1-3H3,(H,26,29)