4-[(2E)-2-[[3-ethoxy-4-(2-ethoxy-2-oxidanylidene-ethoxy)-5-iodanyl-phenyl]methylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[(2E)-2-[[3-ethoxy-4-(2-ethoxy-2-oxidanylidene-ethoxy)-5-iodanyl-phenyl]methylidene]hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-[[3-ethoxy-4-(2-ethoxy-2-oxo-ethoxy)-5-iodo-phenyl]methylene]hydrazino]benzoic acid CAS Name: 4-[(2E)-2-[[3-ethoxy-4-(2-ethoxy-2-oxoethoxy)-5-iodophenyl]methylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-[[3-ethoxy-4-(2-ethoxy-2-oxoethoxy)-5-iodophenyl]methylidene]hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-[3-ethoxy-4-(2-ethoxy-2-keto-ethoxy)-5-iodo-benzylidene]hydrazino]benzoic acid Formula: C20H21IN2O6 MolecularWeight: 512.29501

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC2=CC=C(C=C2)C(=O)O)I)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC2=CC=C(C=C2)C(=O)O)I)OCC(=O)OCC

InChI

InChI=1S/C20H21IN2O6/c1-3-27-17-10-13(9-16(21)19(17)29-12-18(24)28-4-2)11-22-23-15-7-5-14(6-8-15)20(25)26/h5-11,23H,3-4,12H2,1-2H3,(H,25,26)/b22-11+