4-[[7-methyl-8-oxidanyl-6-(trioxidanylsulfanyl)naphthalen-2-yl]amino]benzoic acid

Systemtic Name: 4-[[7-methyl-8-oxidanyl-6-(trioxidanylsulfanyl)naphthalen-2-yl]amino]benzoic acid Openeye Name: 4-[[8-hydroxy-7-methyl-6-(trioxidanylsulfanyl)-2-naphthyl]amino]benzoic acid CAS Name: 4-[[8-hydroxy-7-methyl-6-(trioxidanylthio)-2-naphthalenyl]amino]benzoic acid IUPAC Name: 4-[[8-hydroxy-7-methyl-6-(trioxidanylsulfanyl)naphthalen-2-yl]amino]benzoic acid Traditional Name: 4-[[8-hydroxy-7-methyl-6-(trioxidanylthio)-2-naphthyl]amino]benzoic acid Formula: C18H15NO6S MolecularWeight: 373.3798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=C1O)NC3=CC=C(C=C3)C(=O)O)SOOO

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=C1O)NC3=CC=C(C=C3)C(=O)O)SOOO

InChI

InChI=1S/C18H15NO6S/c1-10-16(26-25-24-23)8-12-4-7-14(9-15(12)17(10)20)19-13-5-2-11(3-6-13)18(21)22/h2-9,19-20,23H,1H3,(H,21,22)