2-[2-[(E)-(5-oxidanylidene-1-propyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(E)-(5-oxidanylidene-1-propyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]ethanoic acid Openeye Name: 2-[2-[(E)-(5-oxo-1-propyl-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]acetic acid CAS Name: 2-[2-[(E)-(5-oxo-1-propyl-2-sulfanylidene-4-imidazolidinylidene)methyl]phenoxy]acetic acid IUPAC Name: 2-[2-[(E)-(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid Traditional Name: 2-[2-[(E)-(5-keto-1-propyl-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]acetic acid Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=CC=CC=C2OCC(=O)O)NC1=S

Isomeric SMILES

CCCN1C(=O)/C(=C\C2=CC=CC=C2OCC(=O)O)/NC1=S

InChI

InChI=1S/C15H16N2O4S/c1-2-7-17-14(20)11(16-15(17)22)8-10-5-3-4-6-12(10)21-9-13(18)19/h3-6,8H,2,7,9H2,1H3,(H,16,22)(H,18,19)/b11-8+