3-[(E)-1,3-diphenylprop-1-enoxy]-2,2-dimethyl-3-oxidanylidene-propanoate

Systemtic Name: 3-[(E)-1,3-diphenylprop-1-enoxy]-2,2-dimethyl-3-oxidanylidene-propanoate Openeye Name: 3-[(E)-1,3-diphenylprop-1-enoxy]-2,2-dimethyl-3-oxo-propanoate CAS Name: 3-[(E)-1,3-diphenylprop-1-enoxy]-2,2-dimethyl-3-oxopropanoate IUPAC Name: 3-[(E)-1,3-diphenylprop-1-enoxy]-2,2-dimethyl-3-oxopropanoate Traditional Name: 3-[(E)-1,3-diphenylprop-1-enoxy]-3-keto-2,2-dimethyl-propionate Formula: C20H19O4- MolecularWeight: 323.36246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)[O-])C(=O)OC(=CCC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C(=O)[O-])C(=O)O/C(=C/CC1=CC=CC=C1)/C2=CC=CC=C2

InChI

InChI=1S/C20H20O4/c1-20(2,18(21)22)19(23)24-17(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3,(H,21,22)/p-1/b17-14+