2-[4-[(Z)-3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl]phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-3-amino-2-cyano-3-thioxo-prop-1-enyl]phenoxy]acetate CAS Name: 2-[4-[(Z)-3-amino-2-cyano-3-sulfanylideneprop-1-enyl]phenoxy]acetate IUPAC Name: 2-[4-[(Z)-3-amino-2-cyano-3-sulfanylideneprop-1-enyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-3-amino-2-cyano-3-thioxo-prop-1-enyl]phenoxy]acetate Formula: C12H9N2O3S- MolecularWeight: 261.27646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C(=S)N)OCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C(/C#N)\C(=S)N)OCC(=O)[O-]

InChI

InChI=1S/C12H10N2O3S/c13-6-9(12(14)18)5-8-1-3-10(4-2-8)17-7-11(15)16/h1-5H,7H2,(H2,14,18)(H,15,16)/p-1/b9-5-