[5-[(3-aminophenyl)methylsulfamoyl]naphthalen-1-yl] 4-methylbenzenesulfonate

Systemtic Name: [5-[(3-aminophenyl)methylsulfamoyl]naphthalen-1-yl] 4-methylbenzenesulfonate Openeye Name: [5-[(3-aminophenyl)methylsulfamoyl]-1-naphthyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-[(3-aminophenyl)methylsulfamoyl]-1-naphthalenyl] ester IUPAC Name: [5-[(3-aminophenyl)methylsulfamoyl]naphthalen-1-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [5-[(3-aminobenzyl)sulfamoyl]-1-naphthyl] ester Formula: C24H22N2O5S2 MolecularWeight: 482.57188

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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)NCC4=CC(=CC=C4)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2C=CC=C3S(=O)(=O)NCC4=CC(=CC=C4)N

InChI

InChI=1S/C24H22N2O5S2/c1-17-11-13-20(14-12-17)33(29,30)31-23-9-3-8-22-21(23)7-4-10-24(22)32(27,28)26-16-18-5-2-6-19(25)15-18/h2-15,26H,16,25H2,1H3