[2-(azepan-1-ylcarbonyl)-7-methyl-imidazo[1,2-a]pyridin-3-yl]methyl-(2-pyridin-4-ylethyl)azanium

Systemtic Name: [2-(azepan-1-ylcarbonyl)-7-methyl-imidazo[1,2-a]pyridin-3-yl]methyl-(2-pyridin-4-ylethyl)azanium Openeye Name: [2-(azepane-1-carbonyl)-7-methyl-imidazo[1,2-a]pyridin-3-yl]methyl-[2-(4-pyridyl)ethyl]ammonium CAS Name: [2-[1-azepanyl(oxo)methyl]-7-methyl-3-imidazo[1,2-a]pyridinyl]methyl-(2-pyridin-4-ylethyl)ammonium IUPAC Name: [2-(azepane-1-carbonyl)-7-methylimidazo[1,2-a]pyridin-3-yl]methyl-(2-pyridin-4-ylethyl)azanium Traditional Name: [2-(azepane-1-carbonyl)-7-methyl-imidazo[1,2-a]pyridin-3-yl]methyl-[2-(4-pyridyl)ethyl]ammonium Formula: C23H30N5O+ MolecularWeight: 392.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N2C=C1)C[NH2+]CCC3=CC=NC=C3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)C[NH2+]CCC3=CC=NC=C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H29N5O/c1-18-9-15-28-20(17-25-12-8-19-6-10-24-11-7-19)22(26-21(28)16-18)23(29)27-13-4-2-3-5-14-27/h6-7,9-11,15-16,25H,2-5,8,12-14,17H2,1H3/p+1