(2R,3R,10bS)-2-(4-fluorophenyl)carbonyl-3-(3-nitrophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile

Systemtic Name: (2R,3R,10bS)-2-(4-fluorophenyl)carbonyl-3-(3-nitrophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile Openeye Name: (2R,3R,10bS)-2-(4-fluorobenzoyl)-3-(3-nitrophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile CAS Name: (2R,3R,10bS)-2-[(4-fluorophenyl)-oxomethyl]-3-(3-nitrophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile IUPAC Name: (2R,3R,10bS)-2-(4-fluorobenzoyl)-3-(3-nitrophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile Traditional Name: (2R,3R,10bS)-2-(4-fluorobenzoyl)-3-(3-nitrophenyl)-3,10b-dihydro-2H-pyrrol[2,1-a]isoquinoline-1,1-dicarbonitrile Formula: C27H17FN4O3 MolecularWeight: 464.447283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3C(C(C(N3C=CC2=C1)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=C(C=C5)F)(C#N)C#N

Isomeric SMILES

C1=CC=C2[C@H]3C([C@H]([C@@H](N3C=CC2=C1)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=C(C=C5)F)(C#N)C#N

InChI

InChI=1S/C27H17FN4O3/c28-20-10-8-18(9-11-20)25(33)23-24(19-5-3-6-21(14-19)32(34)35)31-13-12-17-4-1-2-7-22(17)26(31)27(23,15-29)16-30/h1-14,23-24,26H/t23-,24+,26+/m1/s1