disodium; 4-(2-chloroethyloxycarbonyloxy)benzenesulfonic acid; 1H-imidazol-1-ium

Systemtic Name: disodium; 4-(2-chloroethyloxycarbonyloxy)benzenesulfonic acid; 1H-imidazol-1-ium Openeye Name: disodium; 4-(2-chloroethoxycarbonyloxy)benzenesulfonic acid; 1H-imidazol-1-ium CAS Name: disodium; 4-[2-chloroethoxy(oxo)methoxy]benzenesulfonic acid; 1H-imidazol-1-ium IUPAC Name: disodium; 4-(2-chloroethoxycarbonyloxy)benzenesulfonic acid; 1H-imidazol-1-ium Traditional Name: disodium; 4-(2-chloroethoxycarbonyloxy)besylic acid; 1H-imidazol-1-ium Formula: C12H14ClN2Na2O6S+3 MolecularWeight: 395.7469

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=O)OCCCl)S(=O)(=O)O.C1=CN=C[NH2+]1.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1OC(=O)OCCCl)S(=O)(=O)O.C1=CN=C[NH2+]1.[Na+].[Na+]

InChI

InChI=1S/C9H9ClO6S.C3H4N2.2Na/c10-5-6-15-9(11)16-7-1-3-8(4-2-7)17(12,13)14;1-2-5-3-4-1;;/h1-4H,5-6H2,(H,12,13,14);1-3H,(H,4,5);;/q;;2*+1/p+1