2-[(4Z)-4-(4-methylphenyl)sulfonylimino-1-oxidanylidene-naphthalen-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[(4Z)-4-(4-methylphenyl)sulfonylimino-1-oxidanylidene-naphthalen-2-yl]sulfanylethanoic acid Openeye Name: 2-[[(4Z)-1-oxo-4-(p-tolylsulfonylimino)-2-naphthyl]sulfanyl]acetic acid CAS Name: 2-[[(4Z)-4-(4-methylphenyl)sulfonylimino-1-oxo-2-naphthalenyl]thio]acetic acid IUPAC Name: 2-[(4Z)-4-(4-methylphenyl)sulfonylimino-1-oxonaphthalen-2-yl]sulfanylacetic acid Traditional Name: 2-[[(4Z)-1-keto-4-tosylimino-2-naphthyl]thio]acetic acid Formula: C19H15NO5S2 MolecularWeight: 401.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C2C=C(C(=O)C3=CC=CC=C32)SCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C\2/C=C(C(=O)C3=CC=CC=C32)SCC(=O)O

InChI

InChI=1S/C19H15NO5S2/c1-12-6-8-13(9-7-12)27(24,25)20-16-10-17(26-11-18(21)22)19(23)15-5-3-2-4-14(15)16/h2-10H,11H2,1H3,(H,21,22)/b20-16-