methyl 4-[[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxymethyl]benzoate Openeye Name: methyl 4-[[(E)-2-cyano-3-(4-isopropylphenyl)prop-2-enoyl]oxymethyl]benzoate CAS Name: 4-[[(E)-2-cyano-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxymethyl]benzoate Traditional Name: 4-[[(E)-2-cyano-3-p-cumenyl-acryloyl]oxymethyl]benzoic acid methyl ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)OCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C22H21NO4/c1-15(2)18-8-4-16(5-9-18)12-20(13-23)22(25)27-14-17-6-10-19(11-7-17)21(24)26-3/h4-12,15H,14H2,1-3H3/b20-12+