4-[[4-(imidazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[[4-(imidazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[[4-(imidazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-3,5-dimethyl-isoxazole CAS Name: 4-[[4-(1-imidazolylmethyl)-1-piperidin-1-iumyl]methyl]-3,5-dimethylisoxazole IUPAC Name: 4-[[4-(imidazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[[4-(imidazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-3,5-dimethyl-isoxazole Formula: C15H23N4O+ MolecularWeight: 275.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C[NH+]2CCC(CC2)CN3C=CN=C3

Isomeric SMILES

CC1=C(C(=NO1)C)C[NH+]2CCC(CC2)CN3C=CN=C3

InChI

InChI=1S/C15H22N4O/c1-12-15(13(2)20-17-12)10-18-6-3-14(4-7-18)9-19-8-5-16-11-19/h5,8,11,14H,3-4,6-7,9-10H2,1-2H3/p+1