1-methyl-3-(5-methyl-1,2-oxazol-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-methyl-3-(5-methyl-1,2-oxazol-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)urea Openeye Name: 1-methyl-3-(5-methylisoxazol-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)urea CAS Name: 1-methyl-3-(5-methyl-3-isoxazolyl)-1-(1-methyl-4-piperidin-1-iumyl)urea IUPAC Name: 1-methyl-3-(5-methyl-1,2-oxazol-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)urea Traditional Name: 1-methyl-3-(5-methylisoxazol-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)urea Formula: C12H21N4O2+ MolecularWeight: 253.32074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)N(C)C2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)N(C)C2CC[NH+](CC2)C

InChI

InChI=1S/C12H20N4O2/c1-9-8-11(14-18-9)13-12(17)16(3)10-4-6-15(2)7-5-10/h8,10H,4-7H2,1-3H3,(H,13,14,17)/p+1