3-methyl-2-(1-piperidin-4-ylpiperidin-1-ium-1-yl)carbonyl-4-propan-2-yl-1,2-oxazol-5-one

Systemtic Name: 3-methyl-2-(1-piperidin-4-ylpiperidin-1-ium-1-yl)carbonyl-4-propan-2-yl-1,2-oxazol-5-one Openeye Name: 4-isopropyl-3-methyl-2-[1-(4-piperidyl)piperidin-1-ium-1-carbonyl]isoxazol-5-one CAS Name: 3-methyl-2-[oxo-[1-(4-piperidinyl)-1-piperidin-1-iumyl]methyl]-4-propan-2-yl-5-isoxazolone IUPAC Name: 3-methyl-2-(1-piperidin-4-ylpiperidin-1-ium-1-carbonyl)-4-propan-2-yl-1,2-oxazol-5-one Traditional Name: 4-isopropyl-3-methyl-2-[1-(4-piperidyl)piperidin-1-ium-1-carbonyl]-3-isoxazolin-5-one Formula: C18H30N3O3+ MolecularWeight: 336.4491

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)ON1C(=O)[N+]2(CCCCC2)C3CCNCC3)C(C)C

Isomeric SMILES

CC1=C(C(=O)ON1C(=O)[N+]2(CCCCC2)C3CCNCC3)C(C)C

InChI

InChI=1S/C18H30N3O3/c1-13(2)16-14(3)20(24-17(16)22)18(23)21(11-5-4-6-12-21)15-7-9-19-10-8-15/h13,15,19H,4-12H2,1-3H3/q+1