3-(4-octylpyridin-1-ium-1-yl)-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-(4-octylpyridin-1-ium-1-yl)-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-3-(4-octylpyridin-1-ium-1-yl)naphthalene-1,2-dione CAS Name: 4-hydroxy-3-(4-octyl-1-pyridin-1-iumyl)naphthalene-1,2-dione IUPAC Name: 4-hydroxy-3-(4-octylpyridin-1-ium-1-yl)naphthalene-1,2-dione Traditional Name: 4-hydroxy-3-(4-octylpyridin-1-ium-1-yl)-1,2-naphthoquinone Formula: C23H26NO3+ MolecularWeight: 364.45744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=[N+](C=C1)C2=C(C3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

CCCCCCCCC1=CC=[N+](C=C1)C2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C23H25NO3/c1-2-3-4-5-6-7-10-17-13-15-24(16-14-17)20-21(25)18-11-8-9-12-19(18)22(26)23(20)27/h8-9,11-16H,2-7,10H2,1H3/p+1