(E)-3-(4-butylphenyl)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(4-butylphenyl)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(4-butylphenyl)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]prop-2-enamide CAS Name: (E)-3-(4-butylphenyl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-propenamide IUPAC Name: (E)-3-(4-butylphenyl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(4-butylphenyl)-N-vanillyl-acrylamide Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C=CC(=O)NCC2=CC(=C(C=C2)O)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C21H25NO3/c1-3-4-5-16-6-8-17(9-7-16)11-13-21(24)22-15-18-10-12-19(23)20(14-18)25-2/h6-14,23H,3-5,15H2,1-2H3,(H,22,24)/b13-11+