ethyl 1-[4-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]carbonylphenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]carbonylphenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C25H25FN4O4 MolecularWeight: 464.488803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4F)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4F)C

InChI

InChI=1S/C25H25FN4O4/c1-3-34-25(33)21-16-27-30(17(21)2)19-10-8-18(9-11-19)23(31)28-12-14-29(15-13-28)24(32)20-6-4-5-7-22(20)26/h4-11,16H,3,12-15H2,1-2H3