2,5-bis(chloranyl)aniline; 2-ethoxy-5-(sulfonylamino)benzenesulfonic acid

Systemtic Name: 2,5-bis(chloranyl)aniline; 2-ethoxy-5-(sulfonylamino)benzenesulfonic acid Openeye Name: 2,5-dichloroaniline; 2-ethoxy-5-(sulfonylamino)benzenesulfonic acid CAS Name: 2,5-dichloroaniline; 2-ethoxy-5-(sulfonylamino)benzenesulfonic acid IUPAC Name: 2,5-dichloroaniline; 2-ethoxy-5-(sulfonylamino)benzenesulfonic acid Traditional Name: (2,5-dichlorophenyl)amine; 2-ethoxy-5-(sulfonylamino)besylic acid Formula: C14H14Cl2N2O6S2 MolecularWeight: 441.30676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)N=S(=O)=O)S(=O)(=O)O.C1=CC(=C(C=C1Cl)N)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)N=S(=O)=O)S(=O)(=O)O.C1=CC(=C(C=C1Cl)N)Cl

InChI

InChI=1S/C8H9NO6S2.C6H5Cl2N/c1-2-15-7-4-3-6(9-16(10)11)5-8(7)17(12,13)14;7-4-1-2-5(8)6(9)3-4/h3-5H,2H2,1H3,(H,12,13,14);1-3H,9H2