2-[4-(3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-(3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl)phenoxy]ethanoic acid Openeye Name: 2-[4-(3-amino-2-cyano-3-thioxo-prop-1-enyl)phenoxy]acetic acid CAS Name: 2-[4-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)phenoxy]acetic acid IUPAC Name: 2-[4-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)phenoxy]acetic acid Traditional Name: 2-[4-(3-amino-2-cyano-3-thioxo-prop-1-enyl)phenoxy]acetic acid Formula: C12H10N2O3S MolecularWeight: 262.2844

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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=C1C=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)