[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 2-hydroxy-4-(2-thienylsulfonylamino)benzoate CAS Name: 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-hydroxy-4-(2-thienylsulfonylamino)benzoic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C20H18N2O6S2 MolecularWeight: 446.49672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CS3)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CS3)O

InChI

InChI=1S/C20H18N2O6S2/c23-17-11-15(22-30(26,27)19-7-4-10-29-19)8-9-16(17)20(25)28-13-18(24)21-12-14-5-2-1-3-6-14/h1-11,22-23H,12-13H2,(H,21,24)