(3S)-N-(2,1,3-benzoxadiazol-5-ylmethyl)-1-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2,1,3-benzoxadiazol-5-ylmethyl)-1-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: (3S)-N-(2,1,3-benzoxadiazol-5-ylmethyl)-1-(2-morpholin-4-ium-4-ylethyl)-6-oxo-piperidine-3-carboxamide CAS Name: (3S)-N-(2,1,3-benzoxadiazol-5-ylmethyl)-1-[2-(4-morpholin-4-iumyl)ethyl]-6-oxo-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2,1,3-benzoxadiazol-5-ylmethyl)-1-(2-morpholin-4-ium-4-ylethyl)-6-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-(benzofurazan-5-ylmethyl)-6-keto-1-(2-morpholin-4-ium-4-ylethyl)nipecotamide Formula: C19H26N5O4+ MolecularWeight: 388.44084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCC2=CC3=NON=C3C=C2)CC[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NCC2=CC3=NON=C3C=C2)CC[NH+]4CCOCC4

InChI

InChI=1S/C19H25N5O4/c25-18-4-2-15(13-24(18)6-5-23-7-9-27-10-8-23)19(26)20-12-14-1-3-16-17(11-14)22-28-21-16/h1,3,11,15H,2,4-10,12-13H2,(H,20,26)/p+1/t15-/m0/s1