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

Systemtic Name: (E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-(4-octylphenyl)prop-2-enamide Openeye Name: (E)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-3-(4-octylphenyl)prop-2-enamide CAS Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(4-octylphenyl)-2-propenamide IUPAC Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(4-octylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-octylphenyl)-N-vanillyl-acrylamide Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C=CC(=O)NCC2=CC(=C(C=C2)O)OC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C25H33NO3/c1-3-4-5-6-7-8-9-20-10-12-21(13-11-20)15-17-25(28)26-19-22-14-16-23(27)24(18-22)29-2/h10-18,27H,3-9,19H2,1-2H3,(H,26,28)/b17-15+