5-[(E)-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylhydrazinylidene]methyl]furan-2-sulfonic acid

Systemtic Name: 5-[(E)-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylhydrazinylidene]methyl]furan-2-sulfonic acid Openeye Name: 5-[(E)-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]hydrazono]methyl]furan-2-sulfonic acid CAS Name: 5-[(E)-[[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]hydrazinylidene]methyl]-2-furansulfonic acid IUPAC Name: 5-[(E)-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]hydrazinylidene]methyl]furan-2-sulfonic acid Traditional Name: 5-[(E)-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]hydrazono]methyl]furan-2-sulfonic acid Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NN=CC2=CC=C(O2)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N/N=C/C2=CC=C(O2)S(=O)(=O)O

InChI

InChI=1S/C17H20N2O6S/c1-11(2)14-6-4-12(3)8-15(14)24-10-16(20)19-18-9-13-5-7-17(25-13)26(21,22)23/h4-9,11H,10H2,1-3H3,(H,19,20)(H,21,22,23)/b18-9+