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

Systemtic Name: (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-N-(3-oxidanylpropyl)prop-2-enamide Openeye Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-N-(3-hydroxypropyl)prop-2-enamide CAS Name: (E)-3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-N-(3-hydroxypropyl)-2-propenamide IUPAC Name: (E)-3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N-(3-hydroxypropyl)prop-2-enamide Traditional Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-N-(3-hydroxypropyl)acrylamide Formula: C11H16ClN3O2 MolecularWeight: 257.71664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NCCCO)Cl)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NCCCO)Cl)C

InChI

InChI=1S/C11H16ClN3O2/c1-8-9(11(12)15(2)14-8)4-5-10(17)13-6-3-7-16/h4-5,16H,3,6-7H2,1-2H3,(H,13,17)/b5-4+