[2-acetyloxy-4-[(E)-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-[(E)-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]phenyl] ethanoate Openeye Name: [2-acetoxy-4-[(E)-3-oxo-3-(phenethylamino)prop-1-enyl]phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[(E)-3-oxo-3-(phenethylamino)prop-1-enyl]phenyl] ester IUPAC Name: [2-acetyloxy-4-[(E)-3-oxo-3-(phenethylamino)prop-1-enyl]phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[(E)-3-keto-3-(phenethylamino)prop-1-enyl]phenyl] ester Formula: C21H21NO5 MolecularWeight: 367.39514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=CC(=O)NCCC2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=C/C(=O)NCCC2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C21H21NO5/c1-15(23)26-19-10-8-18(14-20(19)27-16(2)24)9-11-21(25)22-13-12-17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H,22,25)/b11-9+