2-[4-(11-imidazol-1-ylundecylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(11-imidazol-1-ylundecylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(11-imidazol-1-ylundecylamino)phenyl]acetic acid CAS Name: 2-[4-[11-(1-imidazolyl)undecylamino]phenyl]acetic acid IUPAC Name: 2-[4-(11-imidazol-1-ylundecylamino)phenyl]acetic acid Traditional Name: 2-[4-(11-imidazol-1-ylundecylamino)phenyl]acetic acid Formula: C22H33N3O2 MolecularWeight: 371.51632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)NCCCCCCCCCCCN2C=CN=C2

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)NCCCCCCCCCCCN2C=CN=C2

InChI

InChI=1S/C22H33N3O2/c26-22(27)18-20-10-12-21(13-11-20)24-14-8-6-4-2-1-3-5-7-9-16-25-17-15-23-19-25/h10-13,15,17,19,24H,1-9,14,16,18H2,(H,26,27)