ethyl 4-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-methyl-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-methylpropanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H25BrN4O3 MolecularWeight: 401.2987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)CN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)CN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C16H25BrN4O3/c1-5-24-16(23)20-8-6-19(7-9-20)15(22)11(2)10-21-13(4)14(17)12(3)18-21/h11H,5-10H2,1-4H3