piperidin-4-yl (2S)-4-[2,5-bis(fluoranyl)phenyl]-2-phenyl-2,5-dihydropyrrole-1-carboxylate

Systemtic Name: piperidin-4-yl (2S)-4-[2,5-bis(fluoranyl)phenyl]-2-phenyl-2,5-dihydropyrrole-1-carboxylate Openeye Name: 4-piperidyl (2S)-4-(2,5-difluorophenyl)-2-phenyl-2,5-dihydropyrrole-1-carboxylate CAS Name: (2S)-4-(2,5-difluorophenyl)-2-phenyl-2,5-dihydropyrrole-1-carboxylic acid 4-piperidinyl ester IUPAC Name: piperidin-4-yl (2S)-4-(2,5-difluorophenyl)-2-phenyl-2,5-dihydropyrrole-1-carboxylate Traditional Name: (2S)-4-(2,5-difluorophenyl)-2-phenyl-3-pyrroline-1-carboxylic acid 4-piperidyl ester Formula: C22H22F2N2O2 MolecularWeight: 384.419086

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC(=O)N2CC(=CC2C3=CC=CC=C3)C4=C(C=CC(=C4)F)F

Isomeric SMILES

C1CNCCC1OC(=O)N2CC(=C[C@H]2C3=CC=CC=C3)C4=C(C=CC(=C4)F)F

InChI

InChI=1S/C22H22F2N2O2/c23-17-6-7-20(24)19(13-17)16-12-21(15-4-2-1-3-5-15)26(14-16)22(27)28-18-8-10-25-11-9-18/h1-7,12-13,18,21,25H,8-11,14H2/t21-/m0/s1