(2-azanyl-2-oxidanylidene-ethyl) 3,5-bis[(4-ethoxyphenyl)sulfonylamino]benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3,5-bis[(4-ethoxyphenyl)sulfonylamino]benzoate Openeye Name: (2-amino-2-oxo-ethyl) 3,5-bis[(4-ethoxyphenyl)sulfonylamino]benzoate CAS Name: 3,5-bis[(4-ethoxyphenyl)sulfonylamino]benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3,5-bis[(4-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 3,5-bis(p-phenetylsulfonylamino)benzoic acid (2-amino-2-keto-ethyl) ester Formula: C25H27N3O9S2 MolecularWeight: 577.62658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)C(=O)OCC(=O)N)NS(=O)(=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)C(=O)OCC(=O)N)NS(=O)(=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C25H27N3O9S2/c1-3-35-20-5-9-22(10-6-20)38(31,32)27-18-13-17(25(30)37-16-24(26)29)14-19(15-18)28-39(33,34)23-11-7-21(8-12-23)36-4-2/h5-15,27-28H,3-4,16H2,1-2H3,(H2,26,29)