3-[[(4Z)-4-(4-tert-butylphenyl)sulfonylimino-1-oxidanylidene-naphthalen-2-yl]amino]benzoic acid

Systemtic Name: 3-[[(4Z)-4-(4-tert-butylphenyl)sulfonylimino-1-oxidanylidene-naphthalen-2-yl]amino]benzoic acid Openeye Name: 3-[[(4Z)-4-(4-tert-butylphenyl)sulfonylimino-1-oxo-2-naphthyl]amino]benzoic acid CAS Name: 3-[[(4Z)-4-(4-tert-butylphenyl)sulfonylimino-1-oxo-2-naphthalenyl]amino]benzoic acid IUPAC Name: 3-[[(4Z)-4-(4-tert-butylphenyl)sulfonylimino-1-oxonaphthalen-2-yl]amino]benzoic acid Traditional Name: 3-[[(4Z)-4-(4-tert-butylphenyl)sulfonylimino-1-keto-2-naphthyl]amino]benzoic acid Formula: C27H24N2O5S MolecularWeight: 488.55486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N=C2C=C(C(=O)C3=CC=CC=C32)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)/N=C\2/C=C(C(=O)C3=CC=CC=C32)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C27H24N2O5S/c1-27(2,3)18-11-13-20(14-12-18)35(33,34)29-23-16-24(25(30)22-10-5-4-9-21(22)23)28-19-8-6-7-17(15-19)26(31)32/h4-16,28H,1-3H3,(H,31,32)/b29-23-