1-(2-carboxyphenyl)sulfanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid

Systemtic Name: 1-(2-carboxyphenyl)sulfanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid Openeye Name: 1-(2-carboxyphenyl)sulfanyl-9,10-dioxo-anthracene-2-carboxylic acid CAS Name: 1-[(2-carboxyphenyl)thio]-9,10-dioxo-2-anthracenecarboxylic acid IUPAC Name: 1-(2-carboxyphenyl)sulfanyl-9,10-dioxoanthracene-2-carboxylic acid Traditional Name: 1-[(2-carboxyphenyl)thio]-9,10-diketo-anthracene-2-carboxylic acid Formula: C22H12O6S MolecularWeight: 404.39208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)O)SC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)O)SC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H12O6S/c23-18-11-5-1-2-6-12(11)19(24)17-14(18)9-10-15(22(27)28)20(17)29-16-8-4-3-7-13(16)21(25)26/h1-10H,(H,25,26)(H,27,28)