1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone

Systemtic Name: 1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone Openeye Name: 1-[2-(isopropylamino)pyridin-1-ium-1-yl]-2-tetralin-6-yl-ethanone CAS Name: 1-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone IUPAC Name: 1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone Traditional Name: 1-[2-(isopropylamino)pyridin-1-ium-1-yl]-2-tetralin-6-yl-ethanone Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC=[N+]1C(=O)CC2=CC3=C(CCCC3)C=C2

Isomeric SMILES

CC(C)NC1=CC=CC=[N+]1C(=O)CC2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C20H24N2O/c1-15(2)21-19-9-5-6-12-22(19)20(23)14-16-10-11-17-7-3-4-8-18(17)13-16/h5-6,9-13,15H,3-4,7-8,14H2,1-2H3/p+1