ethyl 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C23H25FN4O3 MolecularWeight: 424.468003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)N4C=CC=C4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)N4C=CC=C4

InChI

InChI=1S/C23H25FN4O3/c1-3-31-23(30)17-7-6-14-27(15-17)22(29)20-16(2)25-28(19-10-8-18(24)9-11-19)21(20)26-12-4-5-13-26/h4-5,8-13,17H,3,6-7,14-15H2,1-2H3