2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3-benzoxazole

Systemtic Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3-benzoxazole Openeye Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3-benzoxazole CAS Name: 2-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-1,3-benzoxazole IUPAC Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3-benzoxazole Traditional Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3-benzoxazole Formula: C14H19N2O+ MolecularWeight: 231.31346

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=NC3=CC=CC=C3O2

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C14H18N2O/c1-11-6-4-5-9-16(11)10-14-15-12-7-2-3-8-13(12)17-14/h2-3,7-8,11H,4-6,9-10H2,1H3/p+1/t11-/m0/s1