N-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]-2-(furan-2-yl)ethanamine

Systemtic Name: N-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]-2-(furan-2-yl)ethanamine Openeye Name: N-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]-2-(2-furyl)ethanamine CAS Name: N-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]-2-(2-furanyl)ethanamine IUPAC Name: N-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]-2-(furan-2-yl)ethanamine Traditional Name: [5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl-[2-(2-furyl)ethyl]amine Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C=NN3)CNCCC4=CC=CO4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C=NN3)CNCCC4=CC=CO4

InChI

InChI=1S/C17H17N3O3/c1-2-14(21-7-1)5-6-18-9-13-10-19-20-17(13)12-3-4-15-16(8-12)23-11-22-15/h1-4,7-8,10,18H,5-6,9,11H2,(H,19,20)