[(E)-2-methyl-3-oxidanylidene-3-(2-oxidanylpropoxy)prop-1-enyl] 2-cyano-3,3-diphenyl-prop-2-enoate

Systemtic Name: [(E)-2-methyl-3-oxidanylidene-3-(2-oxidanylpropoxy)prop-1-enyl] 2-cyano-3,3-diphenyl-prop-2-enoate Openeye Name: [(E)-3-(2-hydroxypropoxy)-2-methyl-3-oxo-prop-1-enyl] 2-cyano-3,3-diphenyl-prop-2-enoate CAS Name: 2-cyano-3,3-diphenyl-2-propenoic acid [(E)-3-(2-hydroxypropoxy)-2-methyl-3-oxoprop-1-enyl] ester IUPAC Name: [(E)-3-(2-hydroxypropoxy)-2-methyl-3-oxoprop-1-enyl] 2-cyano-3,3-diphenylprop-2-enoate Traditional Name: 2-cyano-3,3-diphenyl-acrylic acid [(E)-3-(2-hydroxypropoxy)-3-keto-2-methyl-prop-1-enyl] ester Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C(=COC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C#N)C)O

Isomeric SMILES

CC(COC(=O)/C(=C/OC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C#N)/C)O

InChI

InChI=1S/C23H21NO5/c1-16(22(26)29-15-17(2)25)14-28-23(27)20(13-24)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,14,17,25H,15H2,1-2H3/b16-14+