4-(5-methylfuran-2-yl)carbonyl-5-(3-phenoxyphenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: 4-(5-methylfuran-2-yl)carbonyl-5-(3-phenoxyphenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: 4-(5-methylfuran-2-carbonyl)-5-(3-phenoxyphenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione CAS Name: 4-[(5-methyl-2-furanyl)-oxomethyl]-5-(3-phenoxyphenyl)-1-(3-pyridin-1-iumylmethyl)pyrrolidine-2,3-dione IUPAC Name: 4-(5-methylfuran-2-carbonyl)-5-(3-phenoxyphenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: 4-(5-methyl-2-furoyl)-5-(3-phenoxyphenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-quinone Formula: C28H23N2O5+ MolecularWeight: 467.49262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)C2C(N(C(=O)C2=O)CC3=C[NH+]=CC=C3)C4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(O1)C(=O)C2C(N(C(=O)C2=O)CC3=C[NH+]=CC=C3)C4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H22N2O5/c1-18-12-13-23(34-18)26(31)24-25(30(28(33)27(24)32)17-19-7-6-14-29-16-19)20-8-5-11-22(15-20)35-21-9-3-2-4-10-21/h2-16,24-25H,17H2,1H3/p+1