azepan-1-yl-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)methanone

Systemtic Name: azepan-1-yl-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)methanone Openeye Name: azepan-1-yl-(4-chloro-2,5-dimethyl-pyrazol-3-yl)methanone CAS Name: 1-azepanyl-(4-chloro-2,5-dimethyl-3-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(4-chloro-2,5-dimethylpyrazol-3-yl)methanone Traditional Name: azepan-1-yl-(4-chloro-2,5-dimethyl-pyrazol-3-yl)methanone Formula: C12H18ClN3O MolecularWeight: 255.74382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Cl)C(=O)N2CCCCCC2)C

Isomeric SMILES

CC1=NN(C(=C1Cl)C(=O)N2CCCCCC2)C

InChI

InChI=1S/C12H18ClN3O/c1-9-10(13)11(15(2)14-9)12(17)16-7-5-3-4-6-8-16/h3-8H2,1-2H3