ethyl 4-[2-(4-chloranylpyrazol-1-yl)butanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-chloranylpyrazol-1-yl)butanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-chloropyrazol-1-yl)butanoyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-chloro-1-pyrazolyl)-1-oxobutyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-chloropyrazol-1-yl)butanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-chloropyrazol-1-yl)butanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C14H21ClN4O3 MolecularWeight: 328.79454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C(=O)OCC)N2C=C(C=N2)Cl

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C(=O)OCC)N2C=C(C=N2)Cl

InChI

InChI=1S/C14H21ClN4O3/c1-3-12(19-10-11(15)9-16-19)13(20)17-5-7-18(8-6-17)14(21)22-4-2/h9-10,12H,3-8H2,1-2H3