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

Systemtic Name: 2-[2-(3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl)-4-bromanyl-phenoxy]ethanoic acid Openeye Name: 2-[2-(3-amino-2-cyano-3-thioxo-prop-1-enyl)-4-bromo-phenoxy]acetic acid CAS Name: 2-[2-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)-4-bromophenoxy]acetic acid IUPAC Name: 2-[2-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)-4-bromophenoxy]acetic acid Traditional Name: 2-[2-(3-amino-2-cyano-3-thioxo-prop-1-enyl)-4-bromo-phenoxy]acetic acid Formula: C12H9BrN2O3S MolecularWeight: 341.18046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C=C(C#N)C(=S)N)OCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)C=C(C#N)C(=S)N)OCC(=O)O

InChI

InChI=1S/C12H9BrN2O3S/c13-9-1-2-10(18-6-11(16)17)7(4-9)3-8(5-14)12(15)19/h1-4H,6H2,(H2,15,19)(H,16,17)