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

Systemtic Name: [2-methyl-4-(phenylcarbonyl)phenyl] 3-(4-butoxyphenyl)-2-cyano-prop-2-enoate Openeye Name: (4-benzoyl-2-methyl-phenyl) 3-(4-butoxyphenyl)-2-cyano-prop-2-enoate CAS Name: 3-(4-butoxyphenyl)-2-cyano-2-propenoic acid (4-benzoyl-2-methylphenyl) ester IUPAC Name: (4-benzoyl-2-methylphenyl) 3-(4-butoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: 3-(4-butoxyphenyl)-2-cyano-acrylic acid (4-benzoyl-2-methyl-phenyl) ester Formula: C28H25NO4 MolecularWeight: 439.5024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C28H25NO4/c1-3-4-16-32-25-13-10-21(11-14-25)18-24(19-29)28(31)33-26-15-12-23(17-20(26)2)27(30)22-8-6-5-7-9-22/h5-15,17-18H,3-4,16H2,1-2H3