4-[(E)-[2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]ethanoylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]ethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[2-[(4-bromophenyl)sulfonyl-cyclohexylamino]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[2-[(4-bromophenyl)sulfonyl-cyclohexylamino]acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[2-[brosyl(cyclohexyl)amino]acetyl]hydrazono]methyl]benzoic acid Formula: C22H24BrN3O5S MolecularWeight: 522.41206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC(=O)NN=CC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)N(CC(=O)N/N=C/C2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H24BrN3O5S/c23-18-10-12-20(13-11-18)32(30,31)26(19-4-2-1-3-5-19)15-21(27)25-24-14-16-6-8-17(9-7-16)22(28)29/h6-14,19H,1-5,15H2,(H,25,27)(H,28,29)/b24-14+