2-octadecoxy-5-[[(Z)-(1,3,3-trimethylindol-2-ylidene)amino]sulfamoyl]benzoic acid

Systemtic Name: 2-octadecoxy-5-[[(Z)-(1,3,3-trimethylindol-2-ylidene)amino]sulfamoyl]benzoic acid Openeye Name: 2-octadecoxy-5-[[(Z)-(1,3,3-trimethylindolin-2-ylidene)amino]sulfamoyl]benzoic acid CAS Name: 2-octadecoxy-5-[[(Z)-(1,3,3-trimethyl-2-indolylidene)amino]sulfamoyl]benzoic acid IUPAC Name: 2-octadecoxy-5-[[(Z)-(1,3,3-trimethylindol-2-ylidene)amino]sulfamoyl]benzoic acid Traditional Name: 2-stearyloxy-5-[[(Z)-(1,3,3-trimethylindolin-2-ylidene)amino]sulfamoyl]benzoic acid Formula: C36H55N3O5S MolecularWeight: 641.904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)NN=C2C(C3=CC=CC=C3N2C)(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)N/N=C\2/C(C3=CC=CC=C3N2C)(C)C)C(=O)O

InChI

InChI=1S/C36H55N3O5S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-27-44-33-26-25-29(28-30(33)34(40)41)45(42,43)38-37-35-36(2,3)31-23-20-21-24-32(31)39(35)4/h20-21,23-26,28,38H,5-19,22,27H2,1-4H3,(H,40,41)/b37-35-