6-methyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole

Systemtic Name: 6-methyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole Openeye Name: 6-methyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole CAS Name: 6-methyl-2-(4-piperidin-1-iumyl)-1,3-benzoxazole IUPAC Name: 6-methyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole Traditional Name: 6-methyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole Formula: C13H17N2O+ MolecularWeight: 217.28688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3CC[NH2+]CC3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3CC[NH2+]CC3

InChI

InChI=1S/C13H16N2O/c1-9-2-3-11-12(8-9)16-13(15-11)10-4-6-14-7-5-10/h2-3,8,10,14H,4-7H2,1H3/p+1