2-[4-(3-carboxyphenoxy)sulfinyl-3-oxidanyl-naphthalen-2-yl]-1,3-bis(oxidanylidene)indene-5-carboxylic acid

Systemtic Name: 2-[4-(3-carboxyphenoxy)sulfinyl-3-oxidanyl-naphthalen-2-yl]-1,3-bis(oxidanylidene)indene-5-carboxylic acid Openeye Name: 2-[4-(3-carboxyphenoxy)sulfinyl-3-hydroxy-2-naphthyl]-1,3-dioxo-indane-5-carboxylic acid CAS Name: 2-[4-(3-carboxyphenoxy)sulfinyl-3-hydroxy-2-naphthalenyl]-1,3-dioxo-5-indenecarboxylic acid IUPAC Name: 2-[4-(3-carboxyphenoxy)sulfinyl-3-hydroxynaphthalen-2-yl]-1,3-dioxoindene-5-carboxylic acid Traditional Name: 2-[4-(3-carboxyphenoxy)sulfinyl-3-hydroxy-2-naphthyl]-1,3-diketo-indane-5-carboxylic acid Formula: C27H16O9S MolecularWeight: 516.47554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=C2S(=O)OC3=CC=CC(=C3)C(=O)O)O)C4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=C2S(=O)OC3=CC=CC(=C3)C(=O)O)O)C4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)O

InChI

InChI=1S/C27H16O9S/c28-22-18-9-8-15(27(33)34)12-19(18)23(29)21(22)20-11-13-4-1-2-7-17(13)25(24(20)30)37(35)36-16-6-3-5-14(10-16)26(31)32/h1-12,21,30H,(H,31,32)(H,33,34)