methyl 1-[4-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]benzoyl]isonipecotic acid methyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=CC(=NN3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=CC(=NN3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H25N3O5/c1-31-25(30)18-8-10-28(11-9-18)24(29)17-4-2-16(3-5-17)20-15-21(27-26-20)19-6-7-22-23(14-19)33-13-12-32-22/h2-7,14-15,18H,8-13H2,1H3,(H,26,27)