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

Systemtic Name: ethyl 5-[3,4-bis(fluoranyl)phenyl]-2-piperidin-4-yl-4-pyridin-4-yl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(3,4-difluorophenyl)-2-(4-piperidyl)-4-(4-pyridyl)-1H-pyrrole-3-carboxylate CAS Name: 5-(3,4-difluorophenyl)-2-(4-piperidinyl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3,4-difluorophenyl)-2-piperidin-4-yl-4-pyridin-4-yl-1H-pyrrole-3-carboxylate Traditional Name: 5-(3,4-difluorophenyl)-2-(4-piperidyl)-4-(4-pyridyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H23F2N3O2 MolecularWeight: 411.444426

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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)C4CCNCC4

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=NC=C2)C3=CC(=C(C=C3)F)F)C4CCNCC4

InChI

InChI=1S/C23H23F2N3O2/c1-2-30-23(29)20-19(14-5-9-26-10-6-14)22(16-3-4-17(24)18(25)13-16)28-21(20)15-7-11-27-12-8-15/h3-6,9-10,13,15,27-28H,2,7-8,11-12H2,1H3