tert-butyl 3-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[(4-chlorophenyl)-(1-methyl-2-imidazolyl)methyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H29ClN4O3 MolecularWeight: 432.94366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC(C2=CC=C(C=C2)Cl)C3=NC=CN3C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC(C2=CC=C(C=C2)Cl)C3=NC=CN3C

InChI

InChI=1S/C22H29ClN4O3/c1-22(2,3)30-21(29)27-12-5-6-16(14-27)20(28)25-18(19-24-11-13-26(19)4)15-7-9-17(23)10-8-15/h7-11,13,16,18H,5-6,12,14H2,1-4H3,(H,25,28)