2-[[1,4-bis(oxidanylidene)-3-pyridin-1-ium-1-yl-naphthalen-2-yl]amino]phenolate

Systemtic Name: 2-[[1,4-bis(oxidanylidene)-3-pyridin-1-ium-1-yl-naphthalen-2-yl]amino]phenolate Openeye Name: 2-[(1,4-dioxo-3-pyridin-1-ium-1-yl-2-naphthyl)amino]phenolate CAS Name: 2-[[1,4-dioxo-3-(1-pyridin-1-iumyl)-2-naphthalenyl]amino]phenolate IUPAC Name: 2-[(1,4-dioxo-3-pyridin-1-ium-1-ylnaphthalen-2-yl)amino]phenolate Traditional Name: 2-[(1,4-diketo-3-pyridin-1-ium-1-yl-2-naphthyl)amino]phenolate Formula: C21H14N2O3 MolecularWeight: 342.34746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N2O3/c24-17-11-5-4-10-16(17)22-18-19(23-12-6-1-7-13-23)21(26)15-9-3-2-8-14(15)20(18)25/h1-13H,(H-,22,24,25,26)