2-[(2,6-diethylphenyl)amino]-3-pyridin-1-ium-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-[(2,6-diethylphenyl)amino]-3-pyridin-1-ium-1-yl-naphthalene-1,4-dione Openeye Name: 2-(2,6-diethylanilino)-3-pyridin-1-ium-1-yl-naphthalene-1,4-dione CAS Name: 2-(2,6-diethylanilino)-3-(1-pyridin-1-iumyl)naphthalene-1,4-dione IUPAC Name: 2-(2,6-diethylanilino)-3-pyridin-1-ium-1-ylnaphthalene-1,4-dione Traditional Name: 2-(2,6-diethylanilino)-3-pyridin-1-ium-1-yl-1,4-naphthoquinone Formula: C25H23N2O2+ MolecularWeight: 383.46232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC2=C(C(=O)C3=CC=CC=C3C2=O)[N+]4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC2=C(C(=O)C3=CC=CC=C3C2=O)[N+]4=CC=CC=C4

InChI

InChI=1S/C25H22N2O2/c1-3-17-11-10-12-18(4-2)21(17)26-22-23(27-15-8-5-9-16-27)25(29)20-14-7-6-13-19(20)24(22)28/h5-16H,3-4H2,1-2H3/p+1