(E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-N-(2-methyl-1-oxidanyl-propan-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-N-(2-methyl-1-oxidanyl-propan-2-yl)prop-2-enamide Openeye Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-N-(2-hydroxy-1,1-dimethyl-ethyl)prop-2-enamide CAS Name: (E)-3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-propenamide IUPAC Name: (E)-3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)prop-2-enamide Traditional Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-N-(2-hydroxy-1,1-dimethyl-ethyl)acrylamide Formula: C12H18ClN3O2 MolecularWeight: 271.74322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NC(C)(C)CO)Cl)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NC(C)(C)CO)Cl)C

InChI

InChI=1S/C12H18ClN3O2/c1-8-9(11(13)16(4)15-8)5-6-10(18)14-12(2,3)7-17/h5-6,17H,7H2,1-4H3,(H,14,18)/b6-5+