2-[(3E)-3-[methyl-(4-methylphenyl)sulfonyl-hydrazinylidene]-2-oxidanylidene-indol-1-yl]ethanoic acid

Systemtic Name: 2-[(3E)-3-[methyl-(4-methylphenyl)sulfonyl-hydrazinylidene]-2-oxidanylidene-indol-1-yl]ethanoic acid Openeye Name: 2-[(3E)-3-[methyl(p-tolylsulfonyl)hydrazono]-2-oxo-indolin-1-yl]acetic acid CAS Name: 2-[(3E)-3-[methyl-(4-methylphenyl)sulfonylhydrazinylidene]-2-oxo-1-indolyl]acetic acid IUPAC Name: 2-[(3E)-3-[methyl-(4-methylphenyl)sulfonylhydrazinylidene]-2-oxoindol-1-yl]acetic acid Traditional Name: 2-[(3E)-2-keto-3-[methyl(tosyl)hydrazono]indolin-1-yl]acetic acid Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)N=C2C3=CC=CC=C3N(C2=O)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)/N=C/2\C3=CC=CC=C3N(C2=O)CC(=O)O

InChI

InChI=1S/C18H17N3O5S/c1-12-7-9-13(10-8-12)27(25,26)20(2)19-17-14-5-3-4-6-15(14)21(18(17)24)11-16(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b19-17+