4-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methyl]piperazin-2-one

Systemtic Name: 4-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methyl]piperazin-2-one Openeye Name: 4-[(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyl]piperazin-2-one CAS Name: 4-[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2-piperazinone IUPAC Name: 4-[(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methyl]piperazin-2-one Traditional Name: 4-[(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyl]piperazin-2-one Formula: C16H19ClN4O MolecularWeight: 318.80126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2CCNC(=O)C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1CN2CCNC(=O)C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C16H19ClN4O/c1-12-14(10-20-8-7-18-15(22)11-20)16(17)21(19-12)9-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3,(H,18,22)