3-[4-(6-methylidenehexadecylamino)phenyl]propanoic acid

Systemtic Name: 3-[4-(6-methylidenehexadecylamino)phenyl]propanoic acid Openeye Name: 3-[4-(6-methylenehexadecylamino)phenyl]propanoic acid CAS Name: 3-[4-(6-methylenehexadecylamino)phenyl]propanoic acid IUPAC Name: 3-[4-(6-methylidenehexadecylamino)phenyl]propanoic acid Traditional Name: 3-[4-(6-decylhept-6-enylamino)phenyl]propionic acid Formula: C26H43NO2 MolecularWeight: 401.62512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=C)CCCCCNC1=CC=C(C=C1)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCC(=C)CCCCCNC1=CC=C(C=C1)CCC(=O)O

InChI

InChI=1S/C26H43NO2/c1-3-4-5-6-7-8-9-11-14-23(2)15-12-10-13-22-27-25-19-16-24(17-20-25)18-21-26(28)29/h16-17,19-20,27H,2-15,18,21-22H2,1H3,(H,28,29)