4-[[3-[(2,4-dimethylphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]amino]sulfonylbenzoate

Systemtic Name: 4-[[3-[(2,4-dimethylphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]amino]sulfonylbenzoate Openeye Name: 4-[[3-(2,4-dimethylanilino)-4-oxo-1-naphthylidene]amino]sulfonylbenzoate CAS Name: 4-[[3-(2,4-dimethylanilino)-4-oxo-1-naphthalenylidene]amino]sulfonylbenzoate IUPAC Name: 4-[[3-(2,4-dimethylanilino)-4-oxonaphthalen-1-ylidene]amino]sulfonylbenzoate Traditional Name: 4-[[3-(2,4-dimethylanilino)-4-keto-1-naphthylidene]amino]sulfonylbenzoate Formula: C25H19N2O5S- MolecularWeight: 459.49376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=CC(=NS(=O)(=O)C3=CC=C(C=C3)C(=O)[O-])C4=CC=CC=C4C2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=CC(=NS(=O)(=O)C3=CC=C(C=C3)C(=O)[O-])C4=CC=CC=C4C2=O)C

InChI

InChI=1S/C25H20N2O5S/c1-15-7-12-21(16(2)13-15)26-23-14-22(19-5-3-4-6-20(19)24(23)28)27-33(31,32)18-10-8-17(9-11-18)25(29)30/h3-14,26H,1-2H3,(H,29,30)/p-1