2-[hexadecyl(phenylcarbonyl)amino]ethanoic acid

Systemtic Name: 2-[hexadecyl(phenylcarbonyl)amino]ethanoic acid Openeye Name: 2-[benzoyl(hexadecyl)amino]acetic acid CAS Name: 2-[benzoyl(hexadecyl)amino]acetic acid IUPAC Name: 2-[benzoyl(hexadecyl)amino]acetic acid Traditional Name: 2-[benzoyl(cetyl)amino]acetic acid Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(CC(=O)O)C(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCN(CC(=O)O)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C25H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-26(22-24(27)28)25(29)23-19-16-15-17-20-23/h15-17,19-20H,2-14,18,21-22H2,1H3,(H,27,28)