tert-butyl 4-[4-[(2-ethoxycarbonylphenyl)carbamoyl]-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(2-ethoxycarbonylphenyl)carbamoyl]-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(2-ethoxycarbonylphenyl)carbamoyl]-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-ethoxycarbonylanilino)-oxomethyl]-2-(4-methoxyphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(2-ethoxycarbonylphenyl)carbamoyl]-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-carbethoxyphenyl)carbamoyl]-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H36N4O6 MolecularWeight: 548.63004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)OC)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)OC)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H36N4O6/c1-6-39-28(36)23-9-7-8-10-25(23)32-27(35)24-19-31-34(21-11-13-22(38-5)14-12-21)26(24)20-15-17-33(18-16-20)29(37)40-30(2,3)4/h7-14,19-20H,6,15-18H2,1-5H3,(H,32,35)