methyl (2S)-4,5-bis(oxidanylidene)-3-[oxidanyl(phenyl)methylidene]-1-phenyl-2-piperidin-1-ium-1-yl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-4,5-bis(oxidanylidene)-3-[oxidanyl(phenyl)methylidene]-1-phenyl-2-piperidin-1-ium-1-yl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-3-[hydroxy(phenyl)methylene]-4,5-dioxo-1-phenyl-2-piperidin-1-ium-1-yl-pyrrolidine-2-carboxylate CAS Name: (2S)-3-[hydroxy(phenyl)methylidene]-4,5-dioxo-1-phenyl-2-(1-piperidin-1-iumyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-3-[hydroxy(phenyl)methylidene]-4,5-dioxo-1-phenyl-2-piperidin-1-ium-1-ylpyrrolidine-2-carboxylate Traditional Name: (2S)-3-[hydroxy(phenyl)methylene]-4,5-diketo-1-phenyl-2-piperidin-1-ium-1-yl-pyrrolidine-2-carboxylic acid methyl ester Formula: C24H25N2O5+ MolecularWeight: 421.4657

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C(=C(C2=CC=CC=C2)O)C(=O)C(=O)N1C3=CC=CC=C3)[NH+]4CCCCC4

Isomeric SMILES

COC(=O)[C@]1(C(=C(C2=CC=CC=C2)O)C(=O)C(=O)N1C3=CC=CC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C24H24N2O5/c1-31-23(30)24(25-15-9-4-10-16-25)19(20(27)17-11-5-2-6-12-17)21(28)22(29)26(24)18-13-7-3-8-14-18/h2-3,5-8,11-14,27H,4,9-10,15-16H2,1H3/p+1/t24-/m1/s1