[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methyl-3-pyrrolidin-1-ium-1-yl-propyl]azanium

Systemtic Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methyl-3-pyrrolidin-1-ium-1-yl-propyl]azanium Openeye Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methyl-3-pyrrolidin-1-ium-1-yl-propyl]ammonium CAS Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methyl-3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methyl-3-pyrrolidin-1-ium-1-ylpropyl]azanium Traditional Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-methyl-3-pyrrolidin-1-ium-1-yl-propyl]ammonium Formula: C17H28N2O2+2 MolecularWeight: 292.41642

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)OCCO2)(C[NH3+])C[NH+]3CCCC3

Isomeric SMILES

C[C@](CC1=CC2=C(C=C1)OCCO2)(C[NH3+])C[NH+]3CCCC3

InChI

InChI=1S/C17H26N2O2/c1-17(12-18,13-19-6-2-3-7-19)11-14-4-5-15-16(10-14)21-9-8-20-15/h4-5,10H,2-3,6-9,11-13,18H2,1H3/p+2/t17-/m0/s1