2-(2-methylpyridin-1-ium-1-yl)-3,4-dihydro-2H-phenanthren-1-one bromide

Systemtic Name: 2-(2-methylpyridin-1-ium-1-yl)-3,4-dihydro-2H-phenanthren-1-one bromide Openeye Name: 2-(2-methylpyridin-1-ium-1-yl)-3,4-dihydro-2H-phenanthren-1-one bromide CAS Name: 2-(2-methyl-1-pyridin-1-iumyl)-3,4-dihydro-2H-phenanthren-1-one bromide IUPAC Name: 2-(2-methylpyridin-1-ium-1-yl)-3,4-dihydro-2H-phenanthren-1-one bromide Traditional Name: 2-(2-methylpyridin-1-ium-1-yl)-3,4-dihydro-2H-phenanthren-1-one bromide Formula: C20H18BrNO MolecularWeight: 368.26702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1C2CCC3=C(C2=O)C=CC4=CC=CC=C34.[Br-]

Isomeric SMILES

CC1=CC=CC=[N+]1C2CCC3=C(C2=O)C=CC4=CC=CC=C34.[Br-]

InChI

InChI=1S/C20H18NO.BrH/c1-14-6-4-5-13-21(14)19-12-11-17-16-8-3-2-7-15(16)9-10-18(17)20(19)22;/h2-10,13,19H,11-12H2,1H3;1H/q+1;/p-1