2-[4-(6-methylidenehexadecylamino)phenyl]butanoic acid

Systemtic Name: 2-[4-(6-methylidenehexadecylamino)phenyl]butanoic acid Openeye Name: 2-[4-(6-methylenehexadecylamino)phenyl]butanoic acid CAS Name: 2-[4-(6-methylenehexadecylamino)phenyl]butanoic acid IUPAC Name: 2-[4-(6-methylidenehexadecylamino)phenyl]butanoic acid Traditional Name: 2-[4-(6-decylhept-6-enylamino)phenyl]butyric acid Formula: C27H45NO2 MolecularWeight: 415.6517

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H45NO2/c1-4-6-7-8-9-10-11-13-16-23(3)17-14-12-15-22-28-25-20-18-24(19-21-25)26(5-2)27(29)30/h18-21,26,28H,3-17,22H2,1-2H3,(H,29,30)