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

Systemtic Name: 2-[2-[(E)-2-cyano-3-(1H-indol-3-yl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid Openeye Name: 2-[2-[(E)-2-cyano-3-(1H-indol-3-yl)-3-oxo-prop-1-enyl]phenoxy]acetic acid CAS Name: 2-[2-[(E)-2-cyano-3-(1H-indol-3-yl)-3-oxoprop-1-enyl]phenoxy]acetic acid IUPAC Name: 2-[2-[(E)-2-cyano-3-(1H-indol-3-yl)-3-oxoprop-1-enyl]phenoxy]acetic acid Traditional Name: 2-[2-[(E)-2-cyano-3-(1H-indol-3-yl)-3-keto-prop-1-enyl]phenoxy]acetic acid Formula: C20H14N2O4 MolecularWeight: 346.33616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)C(=O)C2=CNC3=CC=CC=C32)OCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)/C=C(\C#N)/C(=O)C2=CNC3=CC=CC=C32)OCC(=O)O

InChI

InChI=1S/C20H14N2O4/c21-10-14(9-13-5-1-4-8-18(13)26-12-19(23)24)20(25)16-11-22-17-7-3-2-6-15(16)17/h1-9,11,22H,12H2,(H,23,24)/b14-9+