(E)-3-[3-ethoxy-4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-ethoxy-4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-ethoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-ethoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-ethoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-ethoxy-4-[2-keto-2-(phenethylamino)ethoxy]phenyl]acrylic acid Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)O)OCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)O)OCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C21H23NO5/c1-2-26-19-14-17(9-11-21(24)25)8-10-18(19)27-15-20(23)22-13-12-16-6-4-3-5-7-16/h3-11,14H,2,12-13,15H2,1H3,(H,22,23)(H,24,25)/b11-9+