(E,7R,11R)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3,7,11,15-tetramethyl-hexadec-2-enamide

Systemtic Name: (E,7R,11R)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3,7,11,15-tetramethyl-hexadec-2-enamide Openeye Name: (E,7R,11R)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-3,7,11,15-tetramethyl-hexadec-2-enamide CAS Name: (E,7R,11R)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-3,7,11,15-tetramethyl-2-hexadecenamide IUPAC Name: (E,7R,11R)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-3,7,11,15-tetramethylhexadec-2-enamide Traditional Name: (E,7R,11R)-3,7,11,15-tetramethyl-N-vanillyl-hexadec-2-enamide Formula: C28H47NO3 MolecularWeight: 445.67768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCCC(C)CCCC(=CC(=O)NCC1=CC(=C(C=C1)O)OC)C

Isomeric SMILES

C[C@@H](CCC[C@@H](C)CCC/C(=C/C(=O)NCC1=CC(=C(C=C1)O)OC)/C)CCCC(C)C

InChI

InChI=1S/C28H47NO3/c1-21(2)10-7-11-22(3)12-8-13-23(4)14-9-15-24(5)18-28(31)29-20-25-16-17-26(30)27(19-25)32-6/h16-19,21-23,30H,7-15,20H2,1-6H3,(H,29,31)/b24-18+/t22-,23-/m1/s1