4-[4-(2-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]-2,2-dimethyl-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(2-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]-2,2-dimethyl-4-oxidanylidene-butanamide Openeye Name: 4-[4-(2-chloropyridine-3-carbonyl)piperazin-1-yl]-2,2-dimethyl-4-oxo-butanamide CAS Name: 4-[4-[(2-chloro-3-pyridinyl)-oxomethyl]-1-piperazinyl]-2,2-dimethyl-4-oxobutanamide IUPAC Name: 4-[4-(2-chloropyridine-3-carbonyl)piperazin-1-yl]-2,2-dimethyl-4-oxobutanamide Traditional Name: 4-[4-(2-chloronicotinoyl)piperazino]-4-keto-2,2-dimethyl-butyramide Formula: C16H21ClN4O3 MolecularWeight: 352.81594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)Cl)C(=O)N

Isomeric SMILES

CC(C)(CC(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)Cl)C(=O)N

InChI

InChI=1S/C16H21ClN4O3/c1-16(2,15(18)24)10-12(22)20-6-8-21(9-7-20)14(23)11-4-3-5-19-13(11)17/h3-5H,6-10H2,1-2H3,(H2,18,24)