[2-(4-cyclohexylpiperazin-4-ium-1-yl)carbonylimidazo[1,2-a]pyridin-3-yl]methyl-(dicyclopropylmethyl)-methyl-azanium

Systemtic Name: [2-(4-cyclohexylpiperazin-4-ium-1-yl)carbonylimidazo[1,2-a]pyridin-3-yl]methyl-(dicyclopropylmethyl)-methyl-azanium Openeye Name: [2-(4-cyclohexylpiperazin-4-ium-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]methyl-(dicyclopropylmethyl)-methyl-ammonium CAS Name: [2-[(4-cyclohexyl-1-piperazin-4-iumyl)-oxomethyl]-3-imidazo[1,2-a]pyridinyl]methyl-(dicyclopropylmethyl)-methylammonium IUPAC Name: [2-(4-cyclohexylpiperazin-4-ium-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]methyl-(dicyclopropylmethyl)-methylazanium Traditional Name: [2-(4-cyclohexylpiperazin-4-ium-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]methyl-(dicyclopropylmethyl)-methyl-ammonium Formula: C27H41N5O+2 MolecularWeight: 451.64734

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(N=C2N1C=CC=C2)C(=O)N3CC[NH+](CC3)C4CCCCC4)C(C5CC5)C6CC6

Isomeric SMILES

C[NH+](CC1=C(N=C2N1C=CC=C2)C(=O)N3CC[NH+](CC3)C4CCCCC4)C(C5CC5)C6CC6

InChI

InChI=1S/C27H39N5O/c1-29(26(20-10-11-20)21-12-13-21)19-23-25(28-24-9-5-6-14-32(23)24)27(33)31-17-15-30(16-18-31)22-7-3-2-4-8-22/h5-6,9,14,20-22,26H,2-4,7-8,10-13,15-19H2,1H3/p+2