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

Systemtic Name: [(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidin-1-ium-1-yl-butyl]azanium Openeye Name: [(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidin-1-ium-1-yl-butyl]ammonium CAS Name: [(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(1-pyrrolidin-1-iumyl)butyl]ammonium IUPAC Name: [(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidin-1-ium-1-ylbutyl]azanium Traditional Name: [(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrrolidin-1-ium-1-yl-butyl]ammonium Formula: C16H26N2O2+2 MolecularWeight: 278.38984

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CCC[NH3+])C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CCC[NH3+])C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H24N2O2/c17-7-3-4-14(18-8-1-2-9-18)13-5-6-15-16(12-13)20-11-10-19-15/h5-6,12,14H,1-4,7-11,17H2/p+2/t14-/m0/s1