4-[oxidanyl-[1-(phenylsulfonyl)pyrrol-2-yl]methyl]benzoic acid

Systemtic Name: 4-[oxidanyl-[1-(phenylsulfonyl)pyrrol-2-yl]methyl]benzoic acid Openeye Name: 4-[[1-(benzenesulfonyl)pyrrol-2-yl]-hydroxy-methyl]benzoic acid CAS Name: 4-[[1-(benzenesulfonyl)-2-pyrrolyl]-hydroxymethyl]benzoic acid IUPAC Name: 4-[[1-(benzenesulfonyl)pyrrol-2-yl]-hydroxymethyl]benzoic acid Traditional Name: 4-[(1-besylpyrrol-2-yl)-hydroxy-methyl]benzoic acid Formula: C18H15NO5S MolecularWeight: 357.3804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2C(C3=CC=C(C=C3)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2C(C3=CC=C(C=C3)C(=O)O)O

InChI

InChI=1S/C18H15NO5S/c20-17(13-8-10-14(11-9-13)18(21)22)16-7-4-12-19(16)25(23,24)15-5-2-1-3-6-15/h1-12,17,20H,(H,21,22)