(3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-methyl-azanium

Systemtic Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-methyl-azanium Openeye Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-methyl-ammonium CAS Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-methylammonium IUPAC Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-methylazanium Traditional Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-methyl-ammonium Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)[NH+](C)CC3=CC(=NN3)C4CC4

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCCO2)[NH+](C)CC3=CC(=NN3)C4CC4

InChI

InChI=1S/C18H23N3O2/c1-12(14-5-6-17-18(9-14)23-8-7-22-17)21(2)11-15-10-16(20-19-15)13-3-4-13/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,19,20)/p+1/t12-/m0/s1