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

Systemtic Name: tert-butyl 4-[[(1-methylimidazol-2-yl)-phenyl-methyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(1-methylimidazol-2-yl)-phenyl-methyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[(1-methyl-2-imidazolyl)-phenylmethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(1-methylimidazol-2-yl)-phenylmethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[(1-methylimidazol-2-yl)-phenyl-methyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC(C2=CC=CC=C2)C3=NC=CN3C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC(C2=CC=CC=C2)C3=NC=CN3C

InChI

InChI=1S/C22H30N4O3/c1-22(2,3)29-21(28)26-13-10-17(11-14-26)20(27)24-18(16-8-6-5-7-9-16)19-23-12-15-25(19)4/h5-9,12,15,17-18H,10-11,13-14H2,1-4H3,(H,24,27)