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

Systemtic Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C16H27N3O2+2 MolecularWeight: 293.40448

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCC(C2=CC3=C(C=C2)OCCO3)[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)CC[C@@H](C2=CC3=C(C=C2)OCCO3)[NH3+]

InChI

InChI=1S/C16H25N3O2/c1-18-6-8-19(9-7-18)5-4-14(17)13-2-3-15-16(12-13)21-11-10-20-15/h2-3,12,14H,4-11,17H2,1H3/p+2/t14-/m0/s1