16-[(4-cyanophenyl)amino]hexadecanoic acid

Systemtic Name: 16-[(4-cyanophenyl)amino]hexadecanoic acid Openeye Name: 16-(4-cyanoanilino)hexadecanoic acid CAS Name: 16-(4-cyanoanilino)hexadecanoic acid IUPAC Name: 16-(4-cyanoanilino)hexadecanoic acid Traditional Name: 16-(4-cyanoanilino)palmitic acid Formula: C23H36N2O2 MolecularWeight: 372.54414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NCCCCCCCCCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C#N)NCCCCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C23H36N2O2/c24-20-21-15-17-22(18-16-21)25-19-13-11-9-7-5-3-1-2-4-6-8-10-12-14-23(26)27/h15-18,25H,1-14,19H2,(H,26,27)