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

Systemtic Name: 2-azanyl-3-(2-octadecylphenyl)propanoic acid Openeye Name: 2-amino-3-(2-octadecylphenyl)propanoic acid CAS Name: 2-amino-3-(2-octadecylphenyl)propanoic acid IUPAC Name: 2-amino-3-(2-octadecylphenyl)propanoic acid Traditional Name: 2-amino-3-(2-stearylphenyl)propionic acid Formula: C27H47NO2 MolecularWeight: 417.66758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1CC(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1CC(C(=O)O)N

InChI

InChI=1S/C27H47NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-21-18-19-22-25(24)23-26(28)27(29)30/h18-19,21-22,26H,2-17,20,23,28H2,1H3,(H,29,30)