[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-[(3R,4R)-1-methyl-4-oxidanyl-piperidin-1-ium-3-yl]methanone

Systemtic Name: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-[(3R,4R)-1-methyl-4-oxidanyl-piperidin-1-ium-3-yl]methanone Openeye Name: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-[(3R,4R)-4-hydroxy-1-methyl-piperidin-1-ium-3-yl]methanone CAS Name: [4-(1,3-benzoxazol-2-yl)-1-piperazinyl]-[(3R,4R)-4-hydroxy-1-methyl-3-piperidin-1-iumyl]methanone IUPAC Name: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-[(3R,4R)-4-hydroxy-1-methylpiperidin-1-ium-3-yl]methanone Traditional Name: [4-(1,3-benzoxazol-2-yl)piperazino]-[(3R,4R)-4-hydroxy-1-methyl-piperidin-1-ium-3-yl]methanone Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(C(C1)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3)O

Isomeric SMILES

C[NH+]1CC[C@H]([C@@H](C1)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3)O

InChI

InChI=1S/C18H24N4O3/c1-20-7-6-15(23)13(12-20)17(24)21-8-10-22(11-9-21)18-19-14-4-2-3-5-16(14)25-18/h2-5,13,15,23H,6-12H2,1H3/p+1/t13-,15-/m1/s1