2-(3,4-dimethylphenyl)-4-[[(6-methylpyridin-1-ium-2-yl)amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3,4-dimethylphenyl)-4-[[(6-methylpyridin-1-ium-2-yl)amino]methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3,4-dimethylphenyl)-4-[[(6-methylpyridin-1-ium-2-yl)amino]methylene]isoquinoline-1,3-dione CAS Name: 2-(3,4-dimethylphenyl)-4-[[(6-methyl-2-pyridin-1-iumyl)amino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3,4-dimethylphenyl)-4-[[(6-methylpyridin-1-ium-2-yl)amino]methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3,4-dimethylphenyl)-4-[[(6-methylpyridin-1-ium-2-yl)amino]methylene]isoquinoline-1,3-quinone Formula: C24H22N3O2+ MolecularWeight: 384.45038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC(=[NH+]4)C)C2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC(=[NH+]4)C)C2=O)C

InChI

InChI=1S/C24H21N3O2/c1-15-11-12-18(13-16(15)2)27-23(28)20-9-5-4-8-19(20)21(24(27)29)14-25-22-10-6-7-17(3)26-22/h4-14H,1-3H3,(H,25,26)/p+1