(6-nitro-4H-1,3-benzodioxin-8-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-(thiophen-2-ylmethyl)azanium Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]-(2-thienylmethyl)ammonium CAS Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl-[[(2R)-2-oxolanyl]methyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-(thiophen-2-ylmethyl)azanium Traditional Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]-(2-thenyl)ammonium Formula: C19H23N2O5S+ MolecularWeight: 391.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C[NH+](CC2=CC=CS2)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

C1C[C@@H](OC1)C[NH+](CC2=CC=CS2)CC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C19H22N2O5S/c22-21(23)16-7-14(19-15(8-16)12-24-13-26-19)9-20(10-17-3-1-5-25-17)11-18-4-2-6-27-18/h2,4,6-8,17H,1,3,5,9-13H2/p+1/t17-/m1/s1