[2-(azocan-1-yl)pyridin-1-ium-3-yl]methyl-[[(3R)-oxolan-3-yl]methyl]azanium

Systemtic Name: [2-(azocan-1-yl)pyridin-1-ium-3-yl]methyl-[[(3R)-oxolan-3-yl]methyl]azanium Openeye Name: [2-(azocan-1-yl)pyridin-1-ium-3-yl]methyl-[[(3R)-tetrahydrofuran-3-yl]methyl]ammonium CAS Name: [2-(1-azocanyl)-3-pyridin-1-iumyl]methyl-[[(3R)-3-oxolanyl]methyl]ammonium IUPAC Name: [2-(azocan-1-yl)pyridin-1-ium-3-yl]methyl-[[(3R)-oxolan-3-yl]methyl]azanium Traditional Name: [2-(azocan-1-yl)pyridin-1-ium-3-yl]methyl-[[(3R)-tetrahydrofuran-3-yl]methyl]ammonium Formula: C18H31N3O+2 MolecularWeight: 305.45824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C2=C(C=CC=[NH+]2)C[NH2+]CC3CCOC3

Isomeric SMILES

C1CCCN(CCC1)C2=C(C=CC=[NH+]2)C[NH2+]C[C@H]3CCOC3

InChI

InChI=1S/C18H29N3O/c1-2-4-10-21(11-5-3-1)18-17(7-6-9-20-18)14-19-13-16-8-12-22-15-16/h6-7,9,16,19H,1-5,8,10-15H2/p+2/t16-/m1/s1