(2S,4S,5S)-5-azanyl-N-[3-(4-oxidanidylmorpholin-4-ium-4-yl)propyl]-4-oxidanyl-6-phenyl-2-propan-2-yl-hexanamide

Systemtic Name: (2S,4S,5S)-5-azanyl-N-[3-(4-oxidanidylmorpholin-4-ium-4-yl)propyl]-4-oxidanyl-6-phenyl-2-propan-2-yl-hexanamide Openeye Name: (2S,4S,5S)-5-amino-4-hydroxy-2-isopropyl-N-[3-(4-oxidomorpholin-4-ium-4-yl)propyl]-6-phenyl-hexanamide CAS Name: (2S,4S,5S)-5-amino-4-hydroxy-N-[3-(4-oxido-4-morpholin-4-iumyl)propyl]-6-phenyl-2-propan-2-ylhexanamide IUPAC Name: (2S,4S,5S)-5-amino-4-hydroxy-N-[3-(4-oxidomorpholin-4-ium-4-yl)propyl]-6-phenyl-2-propan-2-ylhexanamide Traditional Name: (2S,4S,5S)-5-amino-4-hydroxy-2-isopropyl-N-[3-(4-oxidomorpholin-4-ium-4-yl)propyl]-6-phenyl-hexanamide Formula: C22H37N3O4 MolecularWeight: 407.54688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(C(CC1=CC=CC=C1)N)O)C(=O)NCCC[N+]2(CCOCC2)[O-]

Isomeric SMILES

CC(C)[C@H](C[C@@H]([C@H](CC1=CC=CC=C1)N)O)C(=O)NCCC[N+]2(CCOCC2)[O-]

InChI

InChI=1S/C22H37N3O4/c1-17(2)19(16-21(26)20(23)15-18-7-4-3-5-8-18)22(27)24-9-6-10-25(28)11-13-29-14-12-25/h3-5,7-8,17,19-21,26H,6,9-16,23H2,1-2H3,(H,24,27)/t19-,20-,21-/m0/s1