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

Systemtic Name: (3R,4R)-1-[[5-(2-methylpropyl)thiophen-2-yl]methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[(5-isobutyl-2-thienyl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[[5-(2-methylpropyl)-2-thiophenyl]methyl]-4-(4-morpholin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[[5-(2-methylpropyl)thiophen-2-yl]methyl]-4-morpholin-4-ium-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-[(5-isobutyl-2-thienyl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Formula: C18H32N2O2S+2 MolecularWeight: 340.52388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(S1)C[NH+]2CCC(C(C2)O)[NH+]3CCOCC3

Isomeric SMILES

CC(C)CC1=CC=C(S1)C[NH+]2CC[C@H]([C@@H](C2)O)[NH+]3CCOCC3

InChI

InChI=1S/C18H30N2O2S/c1-14(2)11-15-3-4-16(23-15)12-19-6-5-17(18(21)13-19)20-7-9-22-10-8-20/h3-4,14,17-18,21H,5-13H2,1-2H3/p+2/t17-,18-/m1/s1