2-[2-[(E)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(E)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid Openeye Name: 2-[2-[(E)-3-amino-2-cyano-3-oxo-prop-1-enyl]phenoxy]acetic acid CAS Name: 2-[2-[(E)-3-amino-2-cyano-3-oxoprop-1-enyl]phenoxy]acetic acid IUPAC Name: 2-[2-[(E)-3-amino-2-cyano-3-oxoprop-1-enyl]phenoxy]acetic acid Traditional Name: 2-[2-[(E)-3-amino-2-cyano-3-keto-prop-1-enyl]phenoxy]acetic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C(=C1)/C=C(\C#N)/C(=O)N)OCC(=O)O

InChI

InChI=1S/C12H10N2O4/c13-6-9(12(14)17)5-8-3-1-2-4-10(8)18-7-11(15)16/h1-5H,7H2,(H2,14,17)(H,15,16)/b9-5+