tert-butyl 4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1,3-diphenylpyrazol-4-yl)methyl-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H34N4O3/c1-28(2,3)35-27(34)31-17-15-22(16-18-31)26(33)30(4)19-23-20-32(24-13-9-6-10-14-24)29-25(23)21-11-7-5-8-12-21/h5-14,20,22H,15-19H2,1-4H3