[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-(5-chloro-2-nitro-anilino)-2-oxo-ethyl] 2-(2-thienylsulfonylamino)benzoate CAS Name: 2-(thiophen-2-ylsulfonylamino)benzoic acid [2-(5-chloro-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-chloro-2-nitroanilino)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-(2-thienylsulfonylamino)benzoic acid [2-(5-chloro-2-nitro-anilino)-2-keto-ethyl] ester Formula: C19H14ClN3O7S2 MolecularWeight: 495.91336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-])NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-])NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H14ClN3O7S2/c20-12-7-8-16(23(26)27)15(10-12)21-17(24)11-30-19(25)13-4-1-2-5-14(13)22-32(28,29)18-6-3-9-31-18/h1-10,22H,11H2,(H,21,24)