tert-butyl 4-[2-(2,4-dimethylphenyl)-4-[(1-ethoxycarbonylpiperidin-4-yl)carbamoyl]pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(2,4-dimethylphenyl)-4-[(1-ethoxycarbonylpiperidin-4-yl)carbamoyl]pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2,4-dimethylphenyl)-4-[(1-ethoxycarbonyl-4-piperidyl)carbamoyl]pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(2,4-dimethylphenyl)-4-[[(1-ethoxycarbonyl-4-piperidinyl)amino]-oxomethyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(2,4-dimethylphenyl)-4-[(1-ethoxycarbonylpiperidin-4-yl)carbamoyl]pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(1-carbethoxy-4-piperidyl)carbamoyl]-2-(2,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H43N5O5 MolecularWeight: 553.69292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=C(C=C(C=C3)C)C)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=C(C=C(C=C3)C)C)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H43N5O5/c1-7-39-28(37)33-16-12-23(13-17-33)32-27(36)24-19-31-35(25-9-8-20(2)18-21(25)3)26(24)22-10-14-34(15-11-22)29(38)40-30(4,5)6/h8-9,18-19,22-23H,7,10-17H2,1-6H3,(H,32,36)