methyl 3-(4-fluorophenyl)-5-[4-(2-methoxy-2-oxidanylidene-ethyl)piperazin-1-yl]-1-methyl-4-pyridin-4-yl-pyrrole-2-carboxylate

Systemtic Name: methyl 3-(4-fluorophenyl)-5-[4-(2-methoxy-2-oxidanylidene-ethyl)piperazin-1-yl]-1-methyl-4-pyridin-4-yl-pyrrole-2-carboxylate Openeye Name: methyl 3-(4-fluorophenyl)-5-[4-(2-methoxy-2-oxo-ethyl)piperazin-1-yl]-1-methyl-4-(4-pyridyl)pyrrole-2-carboxylate CAS Name: 3-(4-fluorophenyl)-5-[4-(2-methoxy-2-oxoethyl)-1-piperazinyl]-1-methyl-4-pyridin-4-yl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-fluorophenyl)-5-[4-(2-methoxy-2-oxoethyl)piperazin-1-yl]-1-methyl-4-pyridin-4-ylpyrrole-2-carboxylate Traditional Name: 3-(4-fluorophenyl)-5-[4-(2-keto-2-methoxy-ethyl)piperazino]-1-methyl-4-(4-pyridyl)pyrrole-2-carboxylic acid methyl ester Formula: C25H27FN4O4 MolecularWeight: 466.504683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=C1N2CCN(CC2)CC(=O)OC)C3=CC=NC=C3)C4=CC=C(C=C4)F)C(=O)OC

Isomeric SMILES

CN1C(=C(C(=C1N2CCN(CC2)CC(=O)OC)C3=CC=NC=C3)C4=CC=C(C=C4)F)C(=O)OC

InChI

InChI=1S/C25H27FN4O4/c1-28-23(25(32)34-3)21(17-4-6-19(26)7-5-17)22(18-8-10-27-11-9-18)24(28)30-14-12-29(13-15-30)16-20(31)33-2/h4-11H,12-16H2,1-3H3