3-[(2S,3R,4R)-6-bromanyl-3-nitro-2-phenyl-3,4-dihydro-2H-chromen-4-yl]-1H-indole

Systemtic Name: 3-[(2S,3R,4R)-6-bromanyl-3-nitro-2-phenyl-3,4-dihydro-2H-chromen-4-yl]-1H-indole Openeye Name: 3-[(2S,3R,4R)-6-bromo-3-nitro-2-phenyl-chroman-4-yl]-1H-indole CAS Name: 3-[(2S,3R,4R)-6-bromo-3-nitro-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-yl]-1H-indole IUPAC Name: 3-[(2S,3R,4R)-6-bromo-3-nitro-2-phenyl-3,4-dihydro-2H-chromen-4-yl]-1H-indole Traditional Name: 3-[(2S,3R,4R)-6-bromo-3-nitro-2-phenyl-chroman-4-yl]-1H-indole Formula: C23H17BrN2O3 MolecularWeight: 449.29668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2[C@@H]([C@@H](C3=C(O2)C=CC(=C3)Br)C4=CNC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C23H17BrN2O3/c24-15-10-11-20-17(12-15)21(18-13-25-19-9-5-4-8-16(18)19)22(26(27)28)23(29-20)14-6-2-1-3-7-14/h1-13,21-23,25H/t21-,22+,23-/m0/s1