2-azanyl-3-(2-pentadecanoylphenyl)propanoic acid

Systemtic Name: 2-azanyl-3-(2-pentadecanoylphenyl)propanoic acid Openeye Name: 2-amino-3-(2-pentadecanoylphenyl)propanoic acid CAS Name: 2-amino-3-[2-(1-oxopentadecyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-(2-pentadecanoylphenyl)propanoic acid Traditional Name: 2-amino-3-(2-pentadecanoylphenyl)propionic acid Formula: C24H39NO3 MolecularWeight: 389.57136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)C1=CC=CC=C1CC(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)C1=CC=CC=C1CC(C(=O)O)N

InChI

InChI=1S/C24H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-23(26)21-17-15-14-16-20(21)19-22(25)24(27)28/h14-17,22H,2-13,18-19,25H2,1H3,(H,27,28)