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

Systemtic Name: 3-azanylpropyl (2S)-4-[2,5-bis(fluoranyl)phenyl]-2-phenyl-2,5-dihydropyrrole-1-carboxylate Openeye Name: 3-aminopropyl (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 3-aminopropyl ester IUPAC Name: 3-aminopropyl (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 3-aminopropyl ester Formula: C20H20F2N2O2 MolecularWeight: 358.381806

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC(N1C(=O)OCCCN)C2=CC=CC=C2)C3=C(C=CC(=C3)F)F

Isomeric SMILES

C1C(=C[C@H](N1C(=O)OCCCN)C2=CC=CC=C2)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C20H20F2N2O2/c21-16-7-8-18(22)17(12-16)15-11-19(14-5-2-1-3-6-14)24(13-15)20(25)26-10-4-9-23/h1-3,5-8,11-12,19H,4,9-10,13,23H2/t19-/m0/s1