2-[[4-(hexadecylamino)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(hexadecylamino)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(hexadecylamino)benzoyl]amino]acetic acid CAS Name: 2-[[[4-(hexadecylamino)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-(hexadecylamino)benzoyl]amino]acetic acid Traditional Name: 2-[[4-(cetylamino)benzoyl]amino]acetic acid Formula: C25H42N2O3 MolecularWeight: 418.61258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)NCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)NCC(=O)O

InChI

InChI=1S/C25H42N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26-23-18-16-22(17-19-23)25(30)27-21-24(28)29/h16-19,26H,2-15,20-21H2,1H3,(H,27,30)(H,28,29)