3-[(1-oxidanylidene-4-thiophen-2-ylsulfonylimino-naphthalen-2-yl)amino]benzoate

Systemtic Name: 3-[(1-oxidanylidene-4-thiophen-2-ylsulfonylimino-naphthalen-2-yl)amino]benzoate Openeye Name: 3-[[1-oxo-4-(2-thienylsulfonylimino)-2-naphthyl]amino]benzoate CAS Name: 3-[(1-oxo-4-thiophen-2-ylsulfonylimino-2-naphthalenyl)amino]benzoate IUPAC Name: 3-[(1-oxo-4-thiophen-2-ylsulfonyliminonaphthalen-2-yl)amino]benzoate Traditional Name: 3-[[1-keto-4-(2-thienylsulfonylimino)-2-naphthyl]amino]benzoate Formula: C21H13N2O5S2- MolecularWeight: 437.46832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS(=O)(=O)C3=CC=CS3)C=C(C2=O)NC4=CC=CC(=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS(=O)(=O)C3=CC=CS3)C=C(C2=O)NC4=CC=CC(=C4)C(=O)[O-]

InChI

InChI=1S/C21H14N2O5S2/c24-20-16-8-2-1-7-15(16)17(23-30(27,28)19-9-4-10-29-19)12-18(20)22-14-6-3-5-13(11-14)21(25)26/h1-12,22H,(H,25,26)/p-1