methyl 2-[(2-cyclohexyl-1-ethanoyl-imidazo[1,2-a]pyridin-4-ium-3-yl)amino]ethanoate chloride

Systemtic Name: methyl 2-[(2-cyclohexyl-1-ethanoyl-imidazo[1,2-a]pyridin-4-ium-3-yl)amino]ethanoate chloride Openeye Name: methyl 2-[(1-acetyl-2-cyclohexyl-imidazo[1,2-a]pyridin-4-ium-3-yl)amino]acetate chloride CAS Name: 2-[(1-acetyl-2-cyclohexyl-3-imidazo[1,2-a]pyridin-4-iumyl)amino]acetic acid methyl ester chloride IUPAC Name: methyl 2-[(1-acetyl-2-cyclohexylimidazo[1,2-a]pyridin-4-ium-3-yl)amino]acetate chloride Traditional Name: 2-[(1-acetyl-2-cyclohexyl-imidazo[1,2-a]pyridin-4-ium-3-yl)amino]acetic acid methyl ester chloride Formula: C18H24ClN3O3 MolecularWeight: 365.85446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC=CC=[N+]2C(=C1C3CCCCC3)NCC(=O)OC.[Cl-]

Isomeric SMILES

CC(=O)N1C2=CC=CC=[N+]2C(=C1C3CCCCC3)NCC(=O)OC.[Cl-]

InChI

InChI=1S/C18H24N3O3.ClH/c1-13(22)21-15-10-6-7-11-20(15)18(19-12-16(23)24-2)17(21)14-8-4-3-5-9-14;/h6-7,10-11,14,19H,3-5,8-9,12H2,1-2H3;1H/q+1;/p-1