(2-butoxy-2-oxidanylidene-ethyl) 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: (2-butoxy-2-oxo-ethyl) 2-[[4-(2-furylmethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(2-furanylmethylamino)-3-nitrophenyl]sulfonylamino]acetic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 2-[[4-(furan-2-ylmethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(2-furfurylamino)-3-nitro-phenyl]sulfonylamino]acetic acid (2-butoxy-2-keto-ethyl) ester Formula: C19H23N3O9S MolecularWeight: 469.46562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)COC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O9S/c1-2-3-8-30-19(24)13-31-18(23)12-21-32(27,28)15-6-7-16(17(10-15)22(25)26)20-11-14-5-4-9-29-14/h4-7,9-10,20-21H,2-3,8,11-13H2,1H3