tert-butyl 4-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2-(4-methoxyphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(4-methoxyphenyl)-4-(piperonylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H34N4O6 MolecularWeight: 534.60346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=C(C=C3)OC)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=C(C=C3)OC)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H34N4O6/c1-29(2,3)39-28(35)32-13-11-20(12-14-32)26-23(17-31-33(26)21-6-8-22(36-4)9-7-21)27(34)30-16-19-5-10-24-25(15-19)38-18-37-24/h5-10,15,17,20H,11-14,16,18H2,1-4H3,(H,30,34)