(3R,4R)-1-[(4,5-dimethylfuran-2-yl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-[(4,5-dimethylfuran-2-yl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[(4,5-dimethyl-2-furyl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[(4,5-dimethyl-2-furanyl)methyl]-4-(4-morpholin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[(4,5-dimethylfuran-2-yl)methyl]-4-morpholin-4-ium-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-[(4,5-dimethyl-2-furyl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Formula: C16H28N2O3+2 MolecularWeight: 296.40512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)C[NH+]2CCC(C(C2)O)[NH+]3CCOCC3)C

Isomeric SMILES

CC1=C(OC(=C1)C[NH+]2CC[C@H]([C@@H](C2)O)[NH+]3CCOCC3)C

InChI

InChI=1S/C16H26N2O3/c1-12-9-14(21-13(12)2)10-17-4-3-15(16(19)11-17)18-5-7-20-8-6-18/h9,15-16,19H,3-8,10-11H2,1-2H3/p+2/t15-,16-/m1/s1