2-[2-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid Openeye Name: 2-[2-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxo-prop-1-enyl]phenoxy]acetic acid CAS Name: 2-[2-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxoprop-1-enyl]phenoxy]acetic acid IUPAC Name: 2-[2-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxoprop-1-enyl]phenoxy]acetic acid Traditional Name: 2-[2-[(E)-3-(4-chlorophenyl)-2-cyano-3-keto-prop-1-enyl]phenoxy]acetic acid Formula: C18H12ClNO4 MolecularWeight: 341.74518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)C(=O)C2=CC=C(C=C2)Cl)OCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)Cl)OCC(=O)O

InChI

InChI=1S/C18H12ClNO4/c19-15-7-5-12(6-8-15)18(23)14(10-20)9-13-3-1-2-4-16(13)24-11-17(21)22/h1-9H,11H2,(H,21,22)/b14-9+