N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(9,10-dioxo-1-anthracenyl)-2-[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C24H21N2O3S+ MolecularWeight: 417.50014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C5=CC=CS5

Isomeric SMILES

C1C[C@H]([NH+](C1)CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C5=CC=CS5

InChI

InChI=1S/C24H20N2O3S/c27-21(14-26-12-4-10-19(26)20-11-5-13-30-20)25-18-9-3-8-17-22(18)24(29)16-7-2-1-6-15(16)23(17)28/h1-3,5-9,11,13,19H,4,10,12,14H2,(H,25,27)/p+1/t19-/m0/s1