5-(1,3-benzodioxol-5-yloxymethyl)-N-[(1R,2S)-2-phenylcyclopropyl]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-[(1R,2S)-2-phenylcyclopropyl]-1H-pyrazole-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-[(1R,2S)-2-phenylcyclopropyl]-1H-pyrazole-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-[(1R,2S)-2-phenylcyclopropyl]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-[(1R,2S)-2-phenylcyclopropyl]-1H-pyrazole-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-[(1R,2S)-2-phenylcyclopropyl]-1H-pyrazole-3-carboxamide Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1NC(=O)C2=NNC(=C2)COC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

C1[C@H]([C@@H]1NC(=O)C2=NNC(=C2)COC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C21H19N3O4/c25-21(22-17-10-16(17)13-4-2-1-3-5-13)18-8-14(23-24-18)11-26-15-6-7-19-20(9-15)28-12-27-19/h1-9,16-17H,10-12H2,(H,22,25)(H,23,24)/t16-,17+/m0/s1