[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-propenoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)phenyl]acrylic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C=CC2=CC=C(C=C2)OCC#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)/C=C/C2=CC=C(C=C2)OCC#N

InChI

InChI=1S/C22H21NO4/c1-3-17-4-9-19(10-5-17)22(25)16(2)27-21(24)13-8-18-6-11-20(12-7-18)26-15-14-23/h4-13,16H,3,15H2,1-2H3/b13-8+