2-[4-[(Z)-(4-ethoxycarbonyl-3-oxidanylidene-5-phenylazanyl-thiophen-2-ylidene)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(Z)-(4-ethoxycarbonyl-3-oxidanylidene-5-phenylazanyl-thiophen-2-ylidene)methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(Z)-(5-anilino-4-ethoxycarbonyl-3-oxo-2-thienylidene)methyl]phenoxy]acetic acid CAS Name: 2-[4-[(Z)-(5-anilino-4-ethoxycarbonyl-3-oxo-2-thiophenylidene)methyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(Z)-(5-anilino-4-ethoxycarbonyl-3-oxothiophen-2-ylidene)methyl]phenoxy]acetic acid Traditional Name: 2-[4-[(Z)-(5-anilino-4-carbethoxy-3-keto-2-thienylidene)methyl]phenoxy]acetic acid Formula: C22H19NO6S MolecularWeight: 425.45436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)OCC(=O)O)C1=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C\C2=CC=C(C=C2)OCC(=O)O)/C1=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H19NO6S/c1-2-28-22(27)19-20(26)17(30-21(19)23-15-6-4-3-5-7-15)12-14-8-10-16(11-9-14)29-13-18(24)25/h3-12,23H,2,13H2,1H3,(H,24,25)/b17-12-