1-(1,3-dimethylpyrazol-4-yl)-3-morpholin-4-ium-4-yl-propan-1-one

Systemtic Name: 1-(1,3-dimethylpyrazol-4-yl)-3-morpholin-4-ium-4-yl-propan-1-one Openeye Name: 1-(1,3-dimethylpyrazol-4-yl)-3-morpholin-4-ium-4-yl-propan-1-one CAS Name: 1-(1,3-dimethyl-4-pyrazolyl)-3-(4-morpholin-4-iumyl)-1-propanone IUPAC Name: 1-(1,3-dimethylpyrazol-4-yl)-3-morpholin-4-ium-4-ylpropan-1-one Traditional Name: 1-(1,3-dimethylpyrazol-4-yl)-3-morpholin-4-ium-4-yl-propan-1-one Formula: C12H20N3O2+ MolecularWeight: 238.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)CC[NH+]2CCOCC2)C

Isomeric SMILES

CC1=NN(C=C1C(=O)CC[NH+]2CCOCC2)C

InChI

InChI=1S/C12H19N3O2/c1-10-11(9-14(2)13-10)12(16)3-4-15-5-7-17-8-6-15/h9H,3-8H2,1-2H3/p+1