2-[3-[(4-ethanoylpiperazin-1-yl)methyl]-5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoic acid

Systemtic Name: 2-[3-[(4-ethanoylpiperazin-1-yl)methyl]-5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]ethanoic acid Openeye Name: 2-[3-[(4-acetylpiperazin-1-yl)methyl]-5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid CAS Name: 2-[3-[(4-acetyl-1-piperazinyl)methyl]-5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid IUPAC Name: 2-[3-[(4-acetylpiperazin-1-yl)methyl]-5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid Traditional Name: 2-[3-[(4-acetylpiperazino)methyl]-5-methyl-1H-imidazo[1,2-a]pyridin-4-ium-2-yl]acetic acid Formula: C17H23N4O3+ MolecularWeight: 331.38952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC(=C2CN3CCN(CC3)C(=O)C)CC(=O)O

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC(=C2CN3CCN(CC3)C(=O)C)CC(=O)O

InChI

InChI=1S/C17H22N4O3/c1-12-4-3-5-16-18-14(10-17(23)24)15(21(12)16)11-19-6-8-20(9-7-19)13(2)22/h3-5H,6-11H2,1-2H3,(H,23,24)/p+1