2-[(3,4-dichlorophenyl)amino]-3-(3,5-dimethylpyridin-1-ium-1-yl)naphthalene-1,4-dione

Systemtic Name: 2-[(3,4-dichlorophenyl)amino]-3-(3,5-dimethylpyridin-1-ium-1-yl)naphthalene-1,4-dione Openeye Name: 2-(3,4-dichloroanilino)-3-(3,5-dimethylpyridin-1-ium-1-yl)naphthalene-1,4-dione CAS Name: 2-(3,4-dichloroanilino)-3-(3,5-dimethyl-1-pyridin-1-iumyl)naphthalene-1,4-dione IUPAC Name: 2-(3,4-dichloroanilino)-3-(3,5-dimethylpyridin-1-ium-1-yl)naphthalene-1,4-dione Traditional Name: 2-(3,4-dichloroanilino)-3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-naphthoquinone Formula: C23H17Cl2N2O2+ MolecularWeight: 424.29928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)Cl)Cl)C

Isomeric SMILES

CC1=CC(=C[N+](=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C23H16Cl2N2O2/c1-13-9-14(2)12-27(11-13)21-20(26-15-7-8-18(24)19(25)10-15)22(28)16-5-3-4-6-17(16)23(21)29/h3-12H,1-2H3/p+1