azepan-1-yl-[7-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methanone

Systemtic Name: azepan-1-yl-[7-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methanone Openeye Name: azepan-1-yl-[7-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methanone CAS Name: 1-azepanyl-[7-methyl-3-[[4-(4-pyridin-1-iumyl)-1-piperazinyl]methyl]-2-imidazo[1,2-a]pyridinyl]methanone IUPAC Name: azepan-1-yl-[7-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methanone Traditional Name: azepan-1-yl-[7-methyl-3-[(4-pyridin-1-ium-4-ylpiperazino)methyl]imidazo[1,2-a]pyridin-2-yl]methanone Formula: C25H33N6O+ MolecularWeight: 433.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N2C=C1)CN3CCN(CC3)C4=CC=[NH+]C=C4)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)CN3CCN(CC3)C4=CC=[NH+]C=C4)C(=O)N5CCCCCC5

InChI

InChI=1S/C25H32N6O/c1-20-8-13-31-22(19-28-14-16-29(17-15-28)21-6-9-26-10-7-21)24(27-23(31)18-20)25(32)30-11-4-2-3-5-12-30/h6-10,13,18H,2-5,11-12,14-17,19H2,1H3/p+1