2-[2-[(2,6-dimorpholin-4-ylpyridin-1-ium-3-yl)amino]-2-oxidanylidene-ethoxy]ethanoate

Systemtic Name: 2-[2-[(2,6-dimorpholin-4-ylpyridin-1-ium-3-yl)amino]-2-oxidanylidene-ethoxy]ethanoate Openeye Name: 2-[2-[(2,6-dimorpholinopyridin-1-ium-3-yl)amino]-2-oxo-ethoxy]acetate CAS Name: 2-[2-[[2,6-bis(4-morpholinyl)-3-pyridin-1-iumyl]amino]-2-oxoethoxy]acetate IUPAC Name: 2-[2-[(2,6-dimorpholin-4-ylpyridin-1-ium-3-yl)amino]-2-oxoethoxy]acetate Traditional Name: 2-[2-[(2,6-dimorpholinopyridin-1-ium-3-yl)amino]-2-keto-ethoxy]acetate Formula: C17H24N4O6 MolecularWeight: 380.39566

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C(=C(C=C2)NC(=O)COCC(=O)[O-])N3CCOCC3

Isomeric SMILES

C1COCCN1C2=[NH+]C(=C(C=C2)NC(=O)COCC(=O)[O-])N3CCOCC3

InChI

InChI=1S/C17H24N4O6/c22-15(11-27-12-16(23)24)18-13-1-2-14(20-3-7-25-8-4-20)19-17(13)21-5-9-26-10-6-21/h1-2H,3-12H2,(H,18,22)(H,23,24)