[1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl] 4-pyren-1-ylbutanoate

Systemtic Name: [1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl] 4-pyren-1-ylbutanoate Openeye Name: (1-hydroxy-2,5-dioxo-pyrrolidin-1-ium-1-yl) 4-pyren-1-ylbutanoate CAS Name: 4-(1-pyrenyl)butanoic acid (1-hydroxy-2,5-dioxo-1-pyrrolidin-1-iumyl) ester IUPAC Name: (1-hydroxy-2,5-dioxopyrrolidin-1-ium-1-yl) 4-pyren-1-ylbutanoate Traditional Name: 4-pyren-1-ylbutyric acid (1-hydroxy-2,5-diketo-pyrrolidin-1-ium-1-yl) ester Formula: C24H20NO5+ MolecularWeight: 402.4193

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)[N+](C1=O)(O)OC(=O)CCCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

Isomeric SMILES

C1CC(=O)[N+](C1=O)(O)OC(=O)CCCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

InChI

InChI=1S/C24H20NO5/c26-20-13-14-21(27)25(20,29)30-22(28)6-2-3-15-7-8-18-10-9-16-4-1-5-17-11-12-19(15)24(18)23(16)17/h1,4-5,7-12,29H,2-3,6,13-14H2/q+1