3-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-oxidanyl-methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione

Systemtic Name: 3-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-oxidanyl-methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Openeye Name: 3-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-hydroxy-methylene]-6,7-dimethoxy-1H-quinoline-2,4-dione CAS Name: 3-[[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione IUPAC Name: 3-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Traditional Name: 3-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-hydroxy-methylene]-6,7-dimethoxy-1H-quinoline-2,4-quinone Formula: C19H26N3O5+ MolecularWeight: 376.42684

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=C2C(=O)C3=CC(=C(C=C3NC2=O)OC)OC)O

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=C2C(=O)C3=CC(=C(C=C3NC2=O)OC)OC)O

InChI

InChI=1S/C19H25N3O5/c1-4-22-7-5-6-11(22)10-20-18(24)16-17(23)12-8-14(26-2)15(27-3)9-13(12)21-19(16)25/h8-9,11,20,24H,4-7,10H2,1-3H3,(H,21,25)/p+1/t11-/m0/s1