2-[4-(dimethylamino)pyridin-1-ium-1-yl]indene-1,3-dione

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]indene-1,3-dione Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]indane-1,3-dione CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]indene-1,3-dione IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]indene-1,3-dione Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]indane-1,3-quinone Formula: C16H15N2O2+ MolecularWeight: 267.3025

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)C2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)C2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H15N2O2/c1-17(2)11-7-9-18(10-8-11)14-15(19)12-5-3-4-6-13(12)16(14)20/h3-10,14H,1-2H3/q+1