2-[[(2S)-2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]sulfamoyl]benzoic acid

Systemtic Name: 2-[[(2S)-2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]sulfamoyl]benzoic acid Openeye Name: 2-[[(2S)-3-(2-allylphenoxy)-2-hydroxy-propyl]sulfamoyl]benzoic acid CAS Name: 2-[[(2S)-2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]sulfamoyl]benzoic acid IUPAC Name: 2-[[(2S)-2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]sulfamoyl]benzoic acid Traditional Name: 2-[[(2S)-3-(2-allylphenoxy)-2-hydroxy-propyl]sulfamoyl]benzoic acid Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(CNS(=O)(=O)C2=CC=CC=C2C(=O)O)O

Isomeric SMILES

C=CCC1=CC=CC=C1OC[C@H](CNS(=O)(=O)C2=CC=CC=C2C(=O)O)O

InChI

InChI=1S/C19H21NO6S/c1-2-7-14-8-3-5-10-17(14)26-13-15(21)12-20-27(24,25)18-11-6-4-9-16(18)19(22)23/h2-6,8-11,15,20-21H,1,7,12-13H2,(H,22,23)/t15-/m0/s1