1-[(2-methoxyoxolan-2-yl)methylcarbamoyloxy]propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate chloride

Systemtic Name: 1-[(2-methoxyoxolan-2-yl)methylcarbamoyloxy]propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate chloride Openeye Name: 1-[(2-methoxytetrahydrofuran-2-yl)methylcarbamoyloxy]propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate chloride CAS Name: 1-(aminomethyl)-2-pyridin-1-iumcarboxylic acid 1-[[(2-methoxy-2-oxolanyl)methylamino]-oxomethoxy]propyl ester chloride IUPAC Name: 1-[(2-methoxyoxolan-2-yl)methylcarbamoyloxy]propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate chloride Traditional Name: 1-(aminomethyl)pyridin-1-ium-2-carboxylic acid 1-[(2-methoxytetrahydrofuran-2-yl)methylcarbamoyloxy]propyl ester chloride Formula: C17H26ClN3O6 MolecularWeight: 403.85784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC(=O)C1=CC=CC=[N+]1CN)OC(=O)NCC2(CCCO2)OC.[Cl-]

Isomeric SMILES

CCC(OC(=O)C1=CC=CC=[N+]1CN)OC(=O)NCC2(CCCO2)OC.[Cl-]

InChI

InChI=1S/C17H25N3O6.ClH/c1-3-14(25-15(21)13-7-4-5-9-20(13)12-18)26-16(22)19-11-17(23-2)8-6-10-24-17;/h4-5,7,9,14H,3,6,8,10-12,18H2,1-2H3;1H