[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 2-(2-thienylsulfonylamino)benzoate CAS Name: 2-(thiophen-2-ylsulfonylamino)benzoic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-(2-thienylsulfonylamino)benzoic acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C19H15N3O7S2 MolecularWeight: 461.4683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15N3O7S2/c23-17(20-13-5-3-6-14(11-13)22(25)26)12-29-19(24)15-7-1-2-8-16(15)21-31(27,28)18-9-4-10-30-18/h1-11,21H,12H2,(H,20,23)