2-[[4-(diethylaminoperoxysulfanyl)phenyl]amino]-5-[(4-methylphenyl)amino]terephthalic acid

Systemtic Name: 2-[[4-(diethylaminoperoxysulfanyl)phenyl]amino]-5-[(4-methylphenyl)amino]terephthalic acid Openeye Name: 2-[4-(diethylaminoperoxysulfanyl)anilino]-5-(4-methylanilino)terephthalic acid CAS Name: 2-[4-(diethylaminodioxythio)anilino]-5-(4-methylanilino)terephthalic acid IUPAC Name: 2-[4-(diethylaminoperoxysulfanyl)anilino]-5-(4-methylanilino)terephthalic acid Traditional Name: 2-[4-(diethylaminoperoxythio)anilino]-5-(p-toluidino)terephthalic acid Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)OOSC1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=C(C=C3)C)C(=O)O

Isomeric SMILES

CCN(CC)OOSC1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=C(C=C3)C)C(=O)O

InChI

InChI=1S/C25H27N3O6S/c1-4-28(5-2)33-34-35-19-12-10-18(11-13-19)27-23-15-20(24(29)30)22(14-21(23)25(31)32)26-17-8-6-16(3)7-9-17/h6-15,26-27H,4-5H2,1-3H3,(H,29,30)(H,31,32)