(2R,3S,4R)-2-(2-bromophenyl)-3-nitro-3,4-dihydro-2H-thiochromen-4-ol

Systemtic Name: (2R,3S,4R)-2-(2-bromophenyl)-3-nitro-3,4-dihydro-2H-thiochromen-4-ol Openeye Name: (2R,3S,4R)-2-(2-bromophenyl)-3-nitro-thiochroman-4-ol CAS Name: (2R,3S,4R)-2-(2-bromophenyl)-3-nitro-3,4-dihydro-2H-1-benzothiopyran-4-ol IUPAC Name: (2R,3S,4R)-2-(2-bromophenyl)-3-nitro-3,4-dihydro-2H-thiochromen-4-ol Traditional Name: (2R,3S,4R)-2-(2-bromophenyl)-3-nitro-thiochroman-4-ol Formula: C15H12BrNO3S MolecularWeight: 366.22968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(C(S2)C3=CC=CC=C3Br)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)[C@H]([C@@H]([C@H](S2)C3=CC=CC=C3Br)[N+](=O)[O-])O

InChI

InChI=1S/C15H12BrNO3S/c16-11-7-3-1-5-9(11)15-13(17(19)20)14(18)10-6-2-4-8-12(10)21-15/h1-8,13-15,18H/t13-,14+,15+/m0/s1