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

Systemtic Name: 4-[(E)-[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[2-[(4-acetamidophenyl)sulfonyl-methylamino]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[2-[(4-acetamidophenyl)sulfonyl-methylamino]acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetyl]hydrazono]methyl]benzoic acid Formula: C19H20N4O6S MolecularWeight: 432.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NN=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N/N=C/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H20N4O6S/c1-13(24)21-16-7-9-17(10-8-16)30(28,29)23(2)12-18(25)22-20-11-14-3-5-15(6-4-14)19(26)27/h3-11H,12H2,1-2H3,(H,21,24)(H,22,25)(H,26,27)/b20-11+