1-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]-1,5-bis(oxidanyl)-3-prop-2-enyl-imidazolidin-1-ium-2-one; prop-1-en-2-olate

Systemtic Name: 1-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]-1,5-bis(oxidanyl)-3-prop-2-enyl-imidazolidin-1-ium-2-one; prop-1-en-2-olate Openeye Name: 3-allyl-1-[3-(1-ethyl-1-methyl-propyl)isoxazol-5-yl]-1,5-dihydroxy-imidazolidin-1-ium-2-one; prop-1-en-2-olate CAS Name: 1,5-dihydroxy-1-[3-(3-methylpentan-3-yl)-5-isoxazolyl]-3-prop-2-enyl-2-imidazolidin-1-iumone; 1-propen-2-olate IUPAC Name: 1,5-dihydroxy-1-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]-3-prop-2-enylimidazolidin-1-ium-2-one; prop-1-en-2-olate Traditional Name: 3-allyl-1-[3-(1-ethyl-1-methyl-propyl)isoxazol-5-yl]-1,5-dihydroxy-imidazolidin-1-ium-2-one; prop-1-en-2-olate Formula: C18H29N3O5 MolecularWeight: 367.43996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC)C1=NOC(=C1)[N+]2(C(CN(C2=O)CC=C)O)O.CC(=C)[O-]

Isomeric SMILES

CCC(C)(CC)C1=NOC(=C1)[N+]2(C(CN(C2=O)CC=C)O)O.CC(=C)[O-]

InChI

InChI=1S/C15H24N3O4.C3H6O/c1-5-8-17-10-12(19)18(21,14(17)20)13-9-11(16-22-13)15(4,6-2)7-3;1-3(2)4/h5,9,12,19,21H,1,6-8,10H2,2-4H3;4H,1H2,2H3/q+1;/p-1