4-(1-butylpiperidin-1-ium-1-yl)-2-ethyl-1,3-benzoxazole

Systemtic Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-ethyl-1,3-benzoxazole Openeye Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-ethyl-1,3-benzoxazole CAS Name: 4-(1-butyl-1-piperidin-1-iumyl)-2-ethyl-1,3-benzoxazole IUPAC Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-ethyl-1,3-benzoxazole Traditional Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-ethyl-1,3-benzoxazole Formula: C18H27N2O+ MolecularWeight: 287.41978

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCCCC1)C2=C3C(=CC=C2)OC(=N3)CC

Isomeric SMILES

CCCC[N+]1(CCCCC1)C2=C3C(=CC=C2)OC(=N3)CC

InChI

InChI=1S/C18H27N2O/c1-3-5-12-20(13-7-6-8-14-20)15-10-9-11-16-18(15)19-17(4-2)21-16/h9-11H,3-8,12-14H2,1-2H3/q+1