(3R)-1-(2,5-dimethylfuran-3-yl)carbonyl-N-(2-morpholin-4-ium-4-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3R)-1-(2,5-dimethylfuran-3-yl)carbonyl-N-(2-morpholin-4-ium-4-ylethyl)piperidine-3-carboxamide Openeye Name: (3R)-1-(2,5-dimethylfuran-3-carbonyl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-3-carboxamide CAS Name: (3R)-1-[(2,5-dimethyl-3-furanyl)-oxomethyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(2,5-dimethylfuran-3-carbonyl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-3-carboxamide Traditional Name: (3R)-1-(2,5-dimethyl-3-furoyl)-N-(2-morpholin-4-ium-4-ylethyl)nipecotamide Formula: C19H30N3O4+ MolecularWeight: 364.4592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N2CCCC(C2)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N2CCC[C@H](C2)C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C19H29N3O4/c1-14-12-17(15(2)26-14)19(24)22-6-3-4-16(13-22)18(23)20-5-7-21-8-10-25-11-9-21/h12,16H,3-11,13H2,1-2H3,(H,20,23)/p+1/t16-/m1/s1