[5-(1,3-benzodioxol-5-yloxymethyl)-1H-pyrazol-3-yl]-[(3S)-3-oxidanylpyrrolidin-1-yl]methanone

Systemtic Name: [5-(1,3-benzodioxol-5-yloxymethyl)-1H-pyrazol-3-yl]-[(3S)-3-oxidanylpyrrolidin-1-yl]methanone Openeye Name: [5-(1,3-benzodioxol-5-yloxymethyl)-1H-pyrazol-3-yl]-[(3S)-3-hydroxypyrrolidin-1-yl]methanone CAS Name: [5-(1,3-benzodioxol-5-yloxymethyl)-1H-pyrazol-3-yl]-[(3S)-3-hydroxy-1-pyrrolidinyl]methanone IUPAC Name: [5-(1,3-benzodioxol-5-yloxymethyl)-1H-pyrazol-3-yl]-[(3S)-3-hydroxypyrrolidin-1-yl]methanone Traditional Name: [5-(1,3-benzodioxol-5-yloxymethyl)-1H-pyrazol-3-yl]-[(3S)-3-hydroxypyrrolidino]methanone Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)C(=O)C2=NNC(=C2)COC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(C[C@H]1O)C(=O)C2=NNC(=C2)COC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H17N3O5/c20-11-3-4-19(7-11)16(21)13-5-10(17-18-13)8-22-12-1-2-14-15(6-12)24-9-23-14/h1-2,5-6,11,20H,3-4,7-9H2,(H,17,18)/t11-/m0/s1