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

Systemtic Name: [1-[(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanyl-butyl]piperidin-1-ium-4-yl]azanium Openeye Name: [1-[(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-butyl]piperidin-1-ium-4-yl]ammonium CAS Name: [1-[(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxybutyl]-4-piperidin-1-iumyl]ammonium IUPAC Name: [1-[(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxybutyl]piperidin-1-ium-4-yl]azanium Traditional Name: [1-[(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-butyl]piperidin-1-ium-4-yl]ammonium Formula: C17H28N2O3+2 MolecularWeight: 308.41582

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH3+])CCCC(C2=CC3=C(C=C2)OCCO3)O

Isomeric SMILES

C1C[NH+](CCC1[NH3+])CCC[C@@H](C2=CC3=C(C=C2)OCCO3)O

InChI

InChI=1S/C17H26N2O3/c18-14-5-8-19(9-6-14)7-1-2-15(20)13-3-4-16-17(12-13)22-11-10-21-16/h3-4,12,14-15,20H,1-2,5-11,18H2/p+2/t15-/m0/s1