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

Systemtic Name: tert-butyl 4-[4-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-(4-methoxyphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H32N4O6 MolecularWeight: 520.57688

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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)NC4=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)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H32N4O6/c1-28(2,3)38-27(34)31-13-11-18(12-14-31)25-22(16-29-32(25)20-6-8-21(35-4)9-7-20)26(33)30-19-5-10-23-24(15-19)37-17-36-23/h5-10,15-16,18H,11-14,17H2,1-4H3,(H,30,33)