3-[(2S,3R,4R)-2-(3-fluorophenyl)-3-nitro-3,4-dihydro-2H-chromen-4-yl]-1H-indole

Systemtic Name: 3-[(2S,3R,4R)-2-(3-fluorophenyl)-3-nitro-3,4-dihydro-2H-chromen-4-yl]-1H-indole Openeye Name: 3-[(2S,3R,4R)-2-(3-fluorophenyl)-3-nitro-chroman-4-yl]-1H-indole CAS Name: 3-[(2S,3R,4R)-2-(3-fluorophenyl)-3-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-1H-indole IUPAC Name: 3-[(2S,3R,4R)-2-(3-fluorophenyl)-3-nitro-3,4-dihydro-2H-chromen-4-yl]-1H-indole Traditional Name: 3-[(2S,3R,4R)-2-(3-fluorophenyl)-3-nitro-chroman-4-yl]-1H-indole Formula: C23H17FN2O3 MolecularWeight: 388.391083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(C(O2)C3=CC(=CC=C3)F)[N+](=O)[O-])C4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)[C@H]([C@H]([C@@H](O2)C3=CC(=CC=C3)F)[N+](=O)[O-])C4=CNC5=CC=CC=C54

InChI

InChI=1S/C23H17FN2O3/c24-15-7-5-6-14(12-15)23-22(26(27)28)21(17-9-2-4-11-20(17)29-23)18-13-25-19-10-3-1-8-16(18)19/h1-13,21-23,25H/t21-,22+,23-/m0/s1