5-[(E)-[2-[(3-methylphenyl)amino]ethanoylhydrazinylidene]methyl]furan-2-sulfonate

Systemtic Name: 5-[(E)-[2-[(3-methylphenyl)amino]ethanoylhydrazinylidene]methyl]furan-2-sulfonate Openeye Name: 5-[(E)-[[2-(3-methylanilino)acetyl]hydrazono]methyl]furan-2-sulfonate CAS Name: 5-[(E)-[[2-(3-methylanilino)-1-oxoethyl]hydrazinylidene]methyl]-2-furansulfonate IUPAC Name: 5-[(E)-[[2-(3-methylanilino)acetyl]hydrazinylidene]methyl]furan-2-sulfonate Traditional Name: 5-[(E)-[[2-(m-toluidino)acetyl]hydrazono]methyl]furan-2-sulfonate Formula: C14H14N3O5S- MolecularWeight: 336.34306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NCC(=O)NN=CC2=CC=C(O2)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NCC(=O)N/N=C/C2=CC=C(O2)S(=O)(=O)[O-]

InChI

InChI=1S/C14H15N3O5S/c1-10-3-2-4-11(7-10)15-9-13(18)17-16-8-12-5-6-14(22-12)23(19,20)21/h2-8,15H,9H2,1H3,(H,17,18)(H,19,20,21)/p-1/b16-8+