2-[3-[(4-ethylpiperazin-1-yl)methyl]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoic acid

Systemtic Name: 2-[3-[(4-ethylpiperazin-1-yl)methyl]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoic acid Openeye Name: 2-[3-[(4-ethylpiperazin-1-yl)methyl]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid CAS Name: 2-[3-[(4-ethyl-1-piperazinyl)methyl]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid IUPAC Name: 2-[3-[(4-ethylpiperazin-1-yl)methyl]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid Traditional Name: 2-[3-[(4-ethylpiperazino)methyl]-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid Formula: C16H23N4O2+ MolecularWeight: 303.37942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(NC3=CC=CC=[N+]32)CC(=O)O

Isomeric SMILES

CCN1CCN(CC1)CC2=C(NC3=CC=CC=[N+]32)CC(=O)O

InChI

InChI=1S/C16H22N4O2/c1-2-18-7-9-19(10-8-18)12-14-13(11-16(21)22)17-15-5-3-4-6-20(14)15/h3-6H,2,7-12H2,1H3,(H,21,22)/p+1