[2-methyl-4-(phenylcarbonyl)phenyl] (E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoate

Systemtic Name: [2-methyl-4-(phenylcarbonyl)phenyl] (E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoate Openeye Name: (4-benzoyl-2-methyl-phenyl) (E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(2-propoxyphenyl)-2-propenoic acid (4-benzoyl-2-methylphenyl) ester IUPAC Name: (4-benzoyl-2-methylphenyl) (E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(2-propoxyphenyl)acrylic acid (4-benzoyl-2-methyl-phenyl) ester Formula: C27H23NO4 MolecularWeight: 425.47582

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=C(C#N)C(=O)OC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCOC1=CC=CC=C1/C=C(\C#N)/C(=O)OC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C27H23NO4/c1-3-15-31-25-12-8-7-11-21(25)17-23(18-28)27(30)32-24-14-13-22(16-19(24)2)26(29)20-9-5-4-6-10-20/h4-14,16-17H,3,15H2,1-2H3/b23-17+