1,3-benzodioxol-5-yl-[(3S)-1-[(5-tert-butyl-1H-pyrazol-3-yl)carbonyl]piperidin-3-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(5-tert-butyl-1H-pyrazol-3-yl)carbonyl]piperidin-3-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[(3S)-1-(5-tert-butyl-1H-pyrazole-3-carbonyl)-3-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(5-tert-butyl-1H-pyrazol-3-yl)-oxomethyl]-3-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[(3S)-1-(5-tert-butyl-1H-pyrazole-3-carbonyl)piperidin-3-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[(3S)-1-(5-tert-butyl-1H-pyrazole-3-carbonyl)-3-piperidyl]methanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)N2CCCC(C2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)N2CCC[C@@H](C2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H25N3O4/c1-21(2,3)18-10-15(22-23-18)20(26)24-8-4-5-14(11-24)19(25)13-6-7-16-17(9-13)28-12-27-16/h6-7,9-10,14H,4-5,8,11-12H2,1-3H3,(H,22,23)/t14-/m0/s1