4-[(E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoyl]piperazin-2-one

Systemtic Name: 4-[(E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoyl]piperazin-2-one Openeye Name: 4-[(E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)prop-2-enoyl]piperazin-2-one CAS Name: 4-[(E)-3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-oxoprop-2-enyl]-2-piperazinone IUPAC Name: 4-[(E)-3-(5-chloro-1,3-dimethylpyrazol-4-yl)prop-2-enoyl]piperazin-2-one Traditional Name: 4-[(E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acryloyl]piperazin-2-one Formula: C12H15ClN4O2 MolecularWeight: 282.7261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCNC(=O)C2)Cl)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)N2CCNC(=O)C2)Cl)C

InChI

InChI=1S/C12H15ClN4O2/c1-8-9(12(13)16(2)15-8)3-4-11(19)17-6-5-14-10(18)7-17/h3-4H,5-7H2,1-2H3,(H,14,18)/b4-3+