1-[(8aS)-2-methyl-3,8a-dihydroimidazo[1,2-a]pyridin-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-[(8aS)-2-methyl-3,8a-dihydroimidazo[1,2-a]pyridin-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-[(8aS)-2-methyl-3,8a-dihydroimidazo[1,2-a]pyridin-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[(8aS)-2-methyl-3,8a-dihydroimidazo[1,2-a]pyridin-3-yl]-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-[(8aS)-2-methyl-3,8a-dihydroimidazo[1,2-a]pyridin-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-[(8aS)-2-methyl-3,8a-dihydroimidazo[1,2-a]pyridin-3-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2C=CC=CN2C1C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=N[C@H]2C=CC=CN2C1C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N4O/c1-16-20(24-10-6-5-9-19(24)21-16)18(25)15-22-11-13-23(14-12-22)17-7-3-2-4-8-17/h2-10,19-20H,11-15H2,1H3/p+1/t19-,20?/m1/s1