tert-butyl 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-methylphenyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-methylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(p-tolyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-(4-methylphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-methylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(p-tolyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H34N4O5 MolecularWeight: 518.60406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC4=C(C=C3)OCCO4)C5CCN(CC5)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC4=C(C=C3)OCCO4)C5CCN(CC5)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H34N4O5/c1-19-5-8-22(9-6-19)33-26(20-11-13-32(14-12-20)28(35)38-29(2,3)4)23(18-30-33)27(34)31-21-7-10-24-25(17-21)37-16-15-36-24/h5-10,17-18,20H,11-16H2,1-4H3,(H,31,34)