[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl] 4-methylbenzenesulfonate

Systemtic Name: [5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl] 4-methylbenzenesulfonate Openeye Name: [5-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]-1-naphthyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]-1-naphthalenyl] ester IUPAC Name: [5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [5-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]-1-naphthyl] ester Formula: C22H20N2O6S2 MolecularWeight: 472.534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2C=CC=C3S(=O)(=O)NC4=C(C(=NO4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2C=CC=C3S(=O)(=O)NC4=C(C(=NO4)C)C

InChI

InChI=1S/C22H20N2O6S2/c1-14-10-12-17(13-11-14)32(27,28)30-20-8-4-7-19-18(20)6-5-9-21(19)31(25,26)24-22-15(2)16(3)23-29-22/h4-13,24H,1-3H3