ethyl 5-[3,4-bis(fluoranyl)phenyl]-2-(1-methylpiperidin-4-yl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[3,4-bis(fluoranyl)phenyl]-2-(1-methylpiperidin-4-yl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(3,4-difluorophenyl)-2-(1-methyl-4-piperidyl)-4-(4-pyridyl)-1H-pyrrole-3-carboxylate CAS Name: 5-(3,4-difluorophenyl)-2-(1-methyl-4-piperidinyl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3,4-difluorophenyl)-2-(1-methylpiperidin-4-yl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylate Traditional Name: 5-(3,4-difluorophenyl)-2-(1-methyl-4-piperidyl)-4-(4-pyridyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H25F2N3O2 MolecularWeight: 425.471006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=NC=C2)C3=CC(=C(C=C3)F)F)C4CCN(CC4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=NC=C2)C3=CC(=C(C=C3)F)F)C4CCN(CC4)C

InChI

InChI=1S/C24H25F2N3O2/c1-3-31-24(30)21-20(15-6-10-27-11-7-15)23(17-4-5-18(25)19(26)14-17)28-22(21)16-8-12-29(2)13-9-16/h4-7,10-11,14,16,28H,3,8-9,12-13H2,1-2H3