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azepan-1-yl-[7-methyl-3-[(2-pyrrolidin-1-ium-1-ylethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methanone
azepan-1-yl-[7-methyl-3-[(2-pyrrolidin-1-ium-1-ylethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methanone
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC2=NC(=C(N2C=C1)CNCC[NH+]3CCCC3)C(=O)N4CCCCCC4
Isomeric SMILES
CC1=CC2=NC(=C(N2C=C1)CNCC[NH+]3CCCC3)C(=O)N4CCCCCC4
InChI
InChI=1S/C22H33N5O/c1-18-8-14-27-19(17-23-9-15-25-10-6-7-11-25)21(24-20(27)16-18)22(28)26-12-4-2-3-5-13-26/h8,14,16,23H,2-7,9-13,15,17H2,1H3/p+1
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