dodecyl (2S)-2-azanyl-3-[3-(3-methoxy-4-oxidanyl-phenyl)propanoyloxy]propanoate

Systemtic Name: dodecyl (2S)-2-azanyl-3-[3-(3-methoxy-4-oxidanyl-phenyl)propanoyloxy]propanoate Openeye Name: dodecyl (2S)-2-amino-3-[3-(4-hydroxy-3-methoxy-phenyl)propanoyloxy]propanoate CAS Name: (2S)-2-amino-3-[3-(4-hydroxy-3-methoxyphenyl)-1-oxopropoxy]propanoic acid dodecyl ester IUPAC Name: dodecyl (2S)-2-amino-3-[3-(4-hydroxy-3-methoxyphenyl)propanoyloxy]propanoate Traditional Name: (2S)-2-amino-3-[3-(4-hydroxy-3-methoxy-phenyl)propanoyloxy]propionic acid lauryl ester Formula: C25H41NO6 MolecularWeight: 451.59614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(COC(=O)CCC1=CC(=C(C=C1)O)OC)N

Isomeric SMILES

CCCCCCCCCCCCOC(=O)[C@H](COC(=O)CCC1=CC(=C(C=C1)O)OC)N

InChI

InChI=1S/C25H41NO6/c1-3-4-5-6-7-8-9-10-11-12-17-31-25(29)21(26)19-32-24(28)16-14-20-13-15-22(27)23(18-20)30-2/h13,15,18,21,27H,3-12,14,16-17,19,26H2,1-2H3/t21-/m0/s1