[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]-[(2R)-4-oxidanylidene-4-phenylazanyl-butan-2-yl]azanium

Systemtic Name: [(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]-[(2R)-4-oxidanylidene-4-phenylazanyl-butan-2-yl]azanium Openeye Name: [(1R)-3-anilino-1-methyl-3-oxo-propyl]-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]ammonium CAS Name: [(2R)-4-anilino-4-oxobutan-2-yl]-[(2R)-2-hydroxy-3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [(2R)-4-anilino-4-oxobutan-2-yl]-[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]azanium Traditional Name: [(1R)-3-anilino-3-keto-1-methyl-propyl]-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]ammonium Formula: C17H29N3O3+2 MolecularWeight: 323.43046

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1)[NH2+]CC(C[NH+]2CCOCC2)O

Isomeric SMILES

C[C@H](CC(=O)NC1=CC=CC=C1)[NH2+]C[C@H](C[NH+]2CCOCC2)O

InChI

InChI=1S/C17H27N3O3/c1-14(11-17(22)19-15-5-3-2-4-6-15)18-12-16(21)13-20-7-9-23-10-8-20/h2-6,14,16,18,21H,7-13H2,1H3,(H,19,22)/p+2/t14-,16-/m1/s1