4-[5-(4-chlorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-(4-chlorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]benzenesulfonamide Openeye Name: 4-[5-(4-chlorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]benzenesulfonamide CAS Name: 4-[5-(4-chlorophenyl)-3,3-bis(hydroxymethyl)-1-cyclopenta-1,4-dienyl]benzenesulfonamide IUPAC Name: 4-[5-(4-chlorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]benzenesulfonamide Traditional Name: 4-[5-(4-chlorophenyl)-3,3-dimethylol-cyclopenta-1,4-dien-1-yl]benzenesulfonamide Formula: C19H18ClNO4S MolecularWeight: 391.86852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(C=C2C3=CC=C(C=C3)Cl)(CO)CO)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1C2=CC(C=C2C3=CC=C(C=C3)Cl)(CO)CO)S(=O)(=O)N

InChI

InChI=1S/C19H18ClNO4S/c20-15-5-1-13(2-6-15)17-9-19(11-22,12-23)10-18(17)14-3-7-16(8-4-14)26(21,24)25/h1-10,22-23H,11-12H2,(H2,21,24,25)