2-[4-(6-imidazol-1-ylhexylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(6-imidazol-1-ylhexylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(6-imidazol-1-ylhexylamino)phenyl]acetic acid CAS Name: 2-[4-[6-(1-imidazolyl)hexylamino]phenyl]acetic acid IUPAC Name: 2-[4-(6-imidazol-1-ylhexylamino)phenyl]acetic acid Traditional Name: 2-[4-(6-imidazol-1-ylhexylamino)phenyl]acetic acid Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)NCCCCCCN2C=CN=C2

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)NCCCCCCN2C=CN=C2

InChI

InChI=1S/C17H23N3O2/c21-17(22)13-15-5-7-16(8-6-15)19-9-3-1-2-4-11-20-12-10-18-14-20/h5-8,10,12,14,19H,1-4,9,11,13H2,(H,21,22)