1-(1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-2-yl)-2-(3-methylpyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-(1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-2-yl)-2-(3-methylpyridin-1-ium-1-yl)ethanone Openeye Name: 1-(1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-2-yl)-2-(3-methylpyridin-1-ium-1-yl)ethanone CAS Name: 1-(1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-2-yl)-2-(3-methyl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-(1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-2-yl)-2-(3-methylpyridin-1-ium-1-yl)ethanone Traditional Name: 1-(1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-2-yl)-2-(3-methylpyridin-1-ium-1-yl)ethanone Formula: C22H32NO+ MolecularWeight: 326.49558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)CC(=O)C2CCC3CC4CCCCC4CC3C2

Isomeric SMILES

CC1=C[N+](=CC=C1)CC(=O)C2CCC3CC4CCCCC4CC3C2

InChI

InChI=1S/C22H32NO/c1-16-5-4-10-23(14-16)15-22(24)20-9-8-19-11-17-6-2-3-7-18(17)12-21(19)13-20/h4-5,10,14,17-21H,2-3,6-9,11-13,15H2,1H3/q+1