2-[(2-chlorophenyl)amino]-3-(3-methylpyridin-1-ium-1-yl)naphthalene-1,4-dione

Systemtic Name: 2-[(2-chlorophenyl)amino]-3-(3-methylpyridin-1-ium-1-yl)naphthalene-1,4-dione Openeye Name: 2-(2-chloroanilino)-3-(3-methylpyridin-1-ium-1-yl)naphthalene-1,4-dione CAS Name: 2-(2-chloroanilino)-3-(3-methyl-1-pyridin-1-iumyl)naphthalene-1,4-dione IUPAC Name: 2-(2-chloroanilino)-3-(3-methylpyridin-1-ium-1-yl)naphthalene-1,4-dione Traditional Name: 2-(2-chloroanilino)-3-(3-methylpyridin-1-ium-1-yl)-1,4-naphthoquinone Formula: C22H16ClN2O2+ MolecularWeight: 375.82764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC=C4Cl

Isomeric SMILES

CC1=C[N+](=CC=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C22H15ClN2O2/c1-14-7-6-12-25(13-14)20-19(24-18-11-5-4-10-17(18)23)21(26)15-8-2-3-9-16(15)22(20)27/h2-13H,1H3/p+1