2-azaniumylethyl-cyclopentyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)azanium

Systemtic Name: 2-azaniumylethyl-cyclopentyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)azanium Openeye Name: 2-azaniumylethyl-cyclopentyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)ammonium CAS Name: 2-ammonioethyl-cyclopentyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)ammonium IUPAC Name: 2-azaniumylethyl-cyclopentyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)azanium Traditional Name: 2-ammonioethyl-cyclopentyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)ammonium Formula: C16H26N2O2+2 MolecularWeight: 278.38984

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+](CC[NH3+])CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCC(C1)[NH+](CC[NH3+])CC2=CC3=C(C=C2)OCCO3

InChI

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