(3R,4aR)-3-propyl-1-pyridin-2-yl-4aH-1,5-naphthyridin-1-ium-2,4-dione

Systemtic Name: (3R,4aR)-3-propyl-1-pyridin-2-yl-4aH-1,5-naphthyridin-1-ium-2,4-dione Openeye Name: (3R,4aR)-3-propyl-1-(2-pyridyl)-4aH-1,5-naphthyridin-1-ium-2,4-dione CAS Name: (3R,4aR)-3-propyl-1-(2-pyridinyl)-4aH-1,5-naphthyridin-1-ium-2,4-dione IUPAC Name: (3R,4aR)-3-propyl-1-pyridin-2-yl-4aH-1,5-naphthyridin-1-ium-2,4-dione Traditional Name: (3R,4aR)-3-propyl-1-(2-pyridyl)-4aH-1,5-naphthyridin-1-ium-2,4-quinone Formula: C16H16N3O2+ MolecularWeight: 282.31714

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)C2C(=[N+](C1=O)C3=CC=CC=N3)C=CC=N2

Isomeric SMILES

CCC[C@@H]1C(=O)[C@H]2C(=[N+](C1=O)C3=CC=CC=N3)C=CC=N2

InChI

InChI=1S/C16H16N3O2/c1-2-6-11-15(20)14-12(7-5-10-18-14)19(16(11)21)13-8-3-4-9-17-13/h3-5,7-11,14H,2,6H2,1H3/q+1/t11-,14-/m1/s1