N-(4-bromanyl-2-nitro-phenyl)-3,4-dihydro-1H-isothiochromen-4-amine

Systemtic Name: N-(4-bromanyl-2-nitro-phenyl)-3,4-dihydro-1H-isothiochromen-4-amine Openeye Name: N-(4-bromo-2-nitro-phenyl)isothiochroman-4-amine CAS Name: N-(4-bromo-2-nitrophenyl)-3,4-dihydro-1H-2-benzothiopyran-4-amine IUPAC Name: N-(4-bromo-2-nitrophenyl)-3,4-dihydro-1H-isothiochromen-4-amine Traditional Name: (4-bromo-2-nitro-phenyl)-isothiochroman-4-yl-amine Formula: C15H13BrN2O2S MolecularWeight: 365.24492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2CS1)NC3=C(C=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1C(C2=CC=CC=C2CS1)NC3=C(C=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H13BrN2O2S/c16-11-5-6-13(15(7-11)18(19)20)17-14-9-21-8-10-3-1-2-4-12(10)14/h1-7,14,17H,8-9H2