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

Systemtic Name: 2-[2-[(E)-2-cyano-3-oxidanylidene-3-[(phenylmethyl)amino]prop-1-enyl]phenoxy]ethanoic acid Openeye Name: 2-[2-[(E)-3-(benzylamino)-2-cyano-3-oxo-prop-1-enyl]phenoxy]acetic acid CAS Name: 2-[2-[(E)-2-cyano-3-oxo-3-[(phenylmethyl)amino]prop-1-enyl]phenoxy]acetic acid IUPAC Name: 2-[2-[(E)-3-(benzylamino)-2-cyano-3-oxoprop-1-enyl]phenoxy]acetic acid Traditional Name: 2-[2-[(E)-3-(benzylamino)-2-cyano-3-keto-prop-1-enyl]phenoxy]acetic acid Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=CC2=CC=CC=C2OCC(=O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)/C(=C/C2=CC=CC=C2OCC(=O)O)/C#N

InChI

InChI=1S/C19H16N2O4/c20-11-16(19(24)21-12-14-6-2-1-3-7-14)10-15-8-4-5-9-17(15)25-13-18(22)23/h1-10H,12-13H2,(H,21,24)(H,22,23)/b16-10+