2-[3-[(2-methylphenyl)carbamoyl]-4-oxidanyl-naphthalen-1-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-[(2-methylphenyl)carbamoyl]-4-oxidanyl-naphthalen-1-yl]sulfanylethanoic acid Openeye Name: 2-[[4-hydroxy-3-(o-tolylcarbamoyl)-1-naphthyl]sulfanyl]acetic acid CAS Name: 2-[[4-hydroxy-3-[(2-methylanilino)-oxomethyl]-1-naphthalenyl]thio]acetic acid IUPAC Name: 2-[4-hydroxy-3-[(2-methylphenyl)carbamoyl]naphthalen-1-yl]sulfanylacetic acid Traditional Name: 2-[[4-hydroxy-3-(o-tolylcarbamoyl)-1-naphthyl]thio]acetic acid Formula: C20H17NO4S MolecularWeight: 367.41828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3C(=C2)SCC(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3C(=C2)SCC(=O)O)O

InChI

InChI=1S/C20H17NO4S/c1-12-6-2-5-9-16(12)21-20(25)15-10-17(26-11-18(22)23)13-7-3-4-8-14(13)19(15)24/h2-10,24H,11H2,1H3,(H,21,25)(H,22,23)