4-(2-imidazol-1-ylethoxycarbonyloxy)benzenesulfonic acid

Systemtic Name: 4-(2-imidazol-1-ylethoxycarbonyloxy)benzenesulfonic acid Openeye Name: 4-(2-imidazol-1-ylethoxycarbonyloxy)benzenesulfonic acid CAS Name: 4-[2-(1-imidazolyl)ethoxy-oxomethoxy]benzenesulfonic acid IUPAC Name: 4-(2-imidazol-1-ylethoxycarbonyloxy)benzenesulfonic acid Traditional Name: 4-(2-imidazol-1-ylethoxycarbonyloxy)besylic acid Formula: C12H12N2O6S MolecularWeight: 312.29848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=O)OCCN2C=CN=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1OC(=O)OCCN2C=CN=C2)S(=O)(=O)O

InChI

InChI=1S/C12H12N2O6S/c15-12(19-8-7-14-6-5-13-9-14)20-10-1-3-11(4-2-10)21(16,17)18/h1-6,9H,7-8H2,(H,16,17,18)