5-methoxy-4-(2-methoxyethoxy)-2-[[4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]benzoate

Systemtic Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]benzoate Openeye Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-[(E)-3-oxido-3-oxo-prop-1-enyl]phenyl]sulfonylamino]benzoate CAS Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]sulfonylamino]benzoate IUPAC Name: 5-methoxy-4-(2-methoxyethoxy)-2-[[4-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]sulfonylamino]benzoate Traditional Name: 2-[[4-[(E)-3-keto-3-oxido-prop-1-enyl]phenyl]sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoate Formula: C20H19NO9S-2 MolecularWeight: 449.43116

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)[O-])C(=O)[O-])OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)[O-])C(=O)[O-])OC

InChI

InChI=1S/C20H21NO9S/c1-28-9-10-30-18-12-16(15(20(24)25)11-17(18)29-2)21-31(26,27)14-6-3-13(4-7-14)5-8-19(22)23/h3-8,11-12,21H,9-10H2,1-2H3,(H,22,23)(H,24,25)/p-2/b8-5+