2-[[(E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]ethanoic acid

Systemtic Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]acetic acid CAS Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-1-oxoprop-2-enyl]amino]acetic acid IUPAC Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino]acetic acid Traditional Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-acryloyl]amino]acetic acid Formula: C12H9ClN2O3 MolecularWeight: 264.66446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C(=O)NCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1/C=C(\C#N)/C(=O)NCC(=O)O)Cl

InChI

InChI=1S/C12H9ClN2O3/c13-10-3-1-8(2-4-10)5-9(6-14)12(18)15-7-11(16)17/h1-5H,7H2,(H,15,18)(H,16,17)/b9-5+