[1-sulfamoyl-6-(2-tetradecoxyphenyl)naphthalen-2-yl] benzenesulfonate

Systemtic Name: [1-sulfamoyl-6-(2-tetradecoxyphenyl)naphthalen-2-yl] benzenesulfonate Openeye Name: [1-sulfamoyl-6-(2-tetradecoxyphenyl)-2-naphthyl] benzenesulfonate CAS Name: benzenesulfonic acid [1-sulfamoyl-6-(2-tetradecoxyphenyl)-2-naphthalenyl] ester IUPAC Name: [1-sulfamoyl-6-(2-tetradecoxyphenyl)naphthalen-2-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [6-(2-myristyloxyphenyl)-1-sulfamoyl-2-naphthyl] ester Formula: C36H45NO6S2 MolecularWeight: 651.8756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1C2=CC3=C(C=C2)C(=C(C=C3)OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1C2=CC3=C(C=C2)C(=C(C=C3)OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C36H45NO6S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-27-42-34-22-17-16-21-32(34)29-23-25-33-30(28-29)24-26-35(36(33)44(37,38)39)43-45(40,41)31-19-14-13-15-20-31/h13-17,19-26,28H,2-12,18,27H2,1H3,(H2,37,38,39)