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

Systemtic Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-[(2R)-oxolan-2-yl]-N-(thiophen-2-ylmethyl)methanamine Openeye Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-[(2R)-tetrahydrofuran-2-yl]-N-(2-thienylmethyl)methanamine CAS Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-[(2R)-2-oxolanyl]-N-(thiophen-2-ylmethyl)methanamine IUPAC Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-[(2R)-oxolan-2-yl]-N-(thiophen-2-ylmethyl)methanamine Traditional Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]-(2-thenyl)amine Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C[C@@H](OC1)CN(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/t17-/m1/s1