2-[4-(heptadecylamino)phenyl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(heptadecylamino)phenyl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(heptadecylamino)phenyl]-2-oxo-acetic acid CAS Name: 2-[4-(heptadecylamino)phenyl]-2-oxoacetic acid IUPAC Name: 2-[4-(heptadecylamino)phenyl]-2-oxoacetic acid Traditional Name: 2-[4-(heptadecylamino)phenyl]-2-keto-acetic acid Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)C(=O)O

InChI

InChI=1S/C25H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26-23-19-17-22(18-20-23)24(27)25(28)29/h17-20,26H,2-16,21H2,1H3,(H,28,29)