2-azanyl-4-(2-methoxyethoxy)-5-nitro-benzenesulfonic acid

Systemtic Name: 2-azanyl-4-(2-methoxyethoxy)-5-nitro-benzenesulfonic acid Openeye Name: 2-amino-4-(2-methoxyethoxy)-5-nitro-benzenesulfonic acid CAS Name: 2-amino-4-(2-methoxyethoxy)-5-nitrobenzenesulfonic acid IUPAC Name: 2-amino-4-(2-methoxyethoxy)-5-nitrobenzenesulfonic acid Traditional Name: 2-amino-4-(2-methoxyethoxy)-5-nitro-besylic acid Formula: C9H12N2O7S MolecularWeight: 292.26578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)N)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)N)S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H12N2O7S/c1-17-2-3-18-8-4-6(10)9(19(14,15)16)5-7(8)11(12)13/h4-5H,2-3,10H2,1H3,(H,14,15,16)