2-[2-ethoxy-6-iodanyl-4-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenoxy]ethanoate

Systemtic Name: 2-[2-ethoxy-6-iodanyl-4-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenoxy]ethanoate Openeye Name: 2-[4-[(E)-(2-anilino-4-oxo-thiazol-5-ylidene)methyl]-2-ethoxy-6-iodo-phenoxy]acetate CAS Name: 2-[4-[(E)-(2-anilino-4-oxo-5-thiazolylidene)methyl]-2-ethoxy-6-iodophenoxy]acetate IUPAC Name: 2-[4-[(E)-(2-anilino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy]acetate Traditional Name: 2-[4-[(E)-(2-anilino-4-keto-2-thiazolin-5-ylidene)methyl]-2-ethoxy-6-iodo-phenoxy]acetate Formula: C20H16IN2O5S- MolecularWeight: 523.32091

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)NC3=CC=CC=C3)I)OCC(=O)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)N=C(S2)NC3=CC=CC=C3)I)OCC(=O)[O-]

InChI

InChI=1S/C20H17IN2O5S/c1-2-27-15-9-12(8-14(21)18(15)28-11-17(24)25)10-16-19(26)23-20(29-16)22-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,24,25)(H,22,23,26)/p-1/b16-10+