6-(4-chlorophenyl)-3-(hydroxymethyl)-2-(1H-imidazol-2-yl)-3-oxidanyl-cyclohexa-1,5-diene-1-sulfonamide

Systemtic Name: 6-(4-chlorophenyl)-3-(hydroxymethyl)-2-(1H-imidazol-2-yl)-3-oxidanyl-cyclohexa-1,5-diene-1-sulfonamide Openeye Name: 6-(4-chlorophenyl)-3-hydroxy-3-(hydroxymethyl)-2-(1H-imidazol-2-yl)cyclohexa-1,5-diene-1-sulfonamide CAS Name: 6-(4-chlorophenyl)-3-hydroxy-3-(hydroxymethyl)-2-(1H-imidazol-2-yl)-1-cyclohexa-1,5-dienesulfonamide IUPAC Name: 6-(4-chlorophenyl)-3-hydroxy-3-(hydroxymethyl)-2-(1H-imidazol-2-yl)cyclohexa-1,5-diene-1-sulfonamide Traditional Name: 6-(4-chlorophenyl)-3-hydroxy-2-(1H-imidazol-2-yl)-3-methylol-cyclohexa-1,5-diene-1-sulfonamide Formula: C16H16ClN3O4S MolecularWeight: 381.83394

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(=C(C1(CO)O)C2=NC=CN2)S(=O)(=O)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C=C(C(=C(C1(CO)O)C2=NC=CN2)S(=O)(=O)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H16ClN3O4S/c17-11-3-1-10(2-4-11)12-5-6-16(22,9-21)13(14(12)25(18,23)24)15-19-7-8-20-15/h1-5,7-8,21-22H,6,9H2,(H,19,20)(H2,18,23,24)