ethanoic acid; 8-[8-(methylcarbamoyl)naphthalen-1-yl]sulfinylnaphthalene-1-carboxylic acid

Systemtic Name: ethanoic acid; 8-[8-(methylcarbamoyl)naphthalen-1-yl]sulfinylnaphthalene-1-carboxylic acid Openeye Name: acetic acid; 8-[[8-(methylcarbamoyl)-1-naphthyl]sulfinyl]naphthalene-1-carboxylic acid CAS Name: acetic acid; 8-[[8-(methylcarbamoyl)-1-naphthalenyl]sulfinyl]-1-naphthalenecarboxylic acid IUPAC Name: acetic acid; 8-[8-(methylcarbamoyl)naphthalen-1-yl]sulfinylnaphthalene-1-carboxylic acid Traditional Name: acetic acid; 8-[[8-(methylcarbamoyl)-1-naphthyl]sulfinyl]-1-naphthoic acid Formula: C25H21NO6S MolecularWeight: 463.50234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CNC(=O)C1=CC=CC2=C1C(=CC=C2)S(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

Isomeric SMILES

CC(=O)O.CNC(=O)C1=CC=CC2=C1C(=CC=C2)S(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

InChI

InChI=1S/C23H17NO4S.C2H4O2/c1-24-22(25)16-10-2-6-14-8-4-12-18(20(14)16)29(28)19-13-5-9-15-7-3-11-17(21(15)19)23(26)27;1-2(3)4/h2-13H,1H3,(H,24,25)(H,26,27);1H3,(H,3,4)