[(2S)-1-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[[2-methyl-2-(4-morpholin-4-iumyl)propyl]amino]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[(2-methyl-2-morpholin-4-ium-4-ylpropyl)amino]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-keto-2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]ethyl]ammonium Formula: C17H29N3O2+2 MolecularWeight: 307.43106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C(CC1=CC=CC=C1)[NH3+])[NH+]2CCOCC2

Isomeric SMILES

CC(C)(CNC(=O)[C@H](CC1=CC=CC=C1)[NH3+])[NH+]2CCOCC2

InChI

InChI=1S/C17H27N3O2/c1-17(2,20-8-10-22-11-9-20)13-19-16(21)15(18)12-14-6-4-3-5-7-14/h3-7,15H,8-13,18H2,1-2H3,(H,19,21)/p+2/t15-/m0/s1