(3R,4R)-4-(azepan-1-ium-1-yl)-1-(oxan-4-yl)piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-4-(azepan-1-ium-1-yl)-1-(oxan-4-yl)piperidin-1-ium-3-ol Openeye Name: (3R,4R)-4-(azepan-1-ium-1-yl)-1-tetrahydropyran-4-yl-piperidin-1-ium-3-ol CAS Name: (3R,4R)-4-(1-azepan-1-iumyl)-1-(4-oxanyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-4-(azepan-1-ium-1-yl)-1-(oxan-4-yl)piperidin-1-ium-3-ol Traditional Name: (3R,4R)-4-(azepan-1-ium-1-yl)-1-tetrahydropyran-4-yl-piperidin-1-ium-3-ol Formula: C16H32N2O2+2 MolecularWeight: 284.43748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2CC[NH+](CC2O)C3CCOCC3

Isomeric SMILES

C1CCC[NH+](CC1)[C@@H]2CC[NH+](C[C@H]2O)C3CCOCC3

InChI

InChI=1S/C16H30N2O2/c19-16-13-18(14-6-11-20-12-7-14)10-5-15(16)17-8-3-1-2-4-9-17/h14-16,19H,1-13H2/p+2/t15-,16-/m1/s1