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

Systemtic Name: 2-[[4-(hexadecylamino)phenyl]amino]ethanoic acid Openeye Name: 2-[4-(hexadecylamino)anilino]acetic acid CAS Name: 2-[4-(hexadecylamino)anilino]acetic acid IUPAC Name: 2-[4-(hexadecylamino)anilino]acetic acid Traditional Name: 2-[4-(cetylamino)anilino]acetic acid Formula: C24H42N2O2 MolecularWeight: 390.60248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H42N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-25-22-16-18-23(19-17-22)26-21-24(27)28/h16-19,25-26H,2-15,20-21H2,1H3,(H,27,28)