3-oxidanyl-4-[2-(phenylmethoxycarbonylamino)ethylsulfonylamino]benzoic acid

Systemtic Name: 3-oxidanyl-4-[2-(phenylmethoxycarbonylamino)ethylsulfonylamino]benzoic acid Openeye Name: 4-[2-(benzyloxycarbonylamino)ethylsulfonylamino]-3-hydroxy-benzoic acid CAS Name: 3-hydroxy-4-[2-(phenylmethoxycarbonylamino)ethylsulfonylamino]benzoic acid IUPAC Name: 3-hydroxy-4-[2-(phenylmethoxycarbonylamino)ethylsulfonylamino]benzoic acid Traditional Name: 4-[2-(benzyloxycarbonylamino)ethylsulfonylamino]-3-hydroxy-benzoic acid Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCS(=O)(=O)NC2=C(C=C(C=C2)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCS(=O)(=O)NC2=C(C=C(C=C2)C(=O)O)O

InChI

InChI=1S/C17H18N2O7S/c20-15-10-13(16(21)22)6-7-14(15)19-27(24,25)9-8-18-17(23)26-11-12-4-2-1-3-5-12/h1-7,10,19-20H,8-9,11H2,(H,18,23)(H,21,22)