4-(phenylcarbonyl)-1-pyridin-1-ium-2-yl-5-pyridin-3-yl-pyrrolidine-2,3-dione

Systemtic Name: 4-(phenylcarbonyl)-1-pyridin-1-ium-2-yl-5-pyridin-3-yl-pyrrolidine-2,3-dione Openeye Name: 4-benzoyl-1-pyridin-1-ium-2-yl-5-(3-pyridyl)pyrrolidine-2,3-dione CAS Name: 4-benzoyl-1-(2-pyridin-1-iumyl)-5-(3-pyridinyl)pyrrolidine-2,3-dione IUPAC Name: 4-benzoyl-1-pyridin-1-ium-2-yl-5-pyridin-3-ylpyrrolidine-2,3-dione Traditional Name: 4-benzoyl-1-pyridin-1-ium-2-yl-5-(3-pyridyl)pyrrolidine-2,3-quinone Formula: C21H16N3O3+ MolecularWeight: 358.37004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)C3=CC=CC=[NH+]3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)C3=CC=CC=[NH+]3)C4=CN=CC=C4

InChI

InChI=1S/C21H15N3O3/c25-19(14-7-2-1-3-8-14)17-18(15-9-6-11-22-13-15)24(21(27)20(17)26)16-10-4-5-12-23-16/h1-13,17-18H/p+1