dimethyl-[3-[(2S,5R)-5-phenyl-2-propan-2-yl-1,3-oxazolidin-3-ium-3-yl]propyl]azanium

Systemtic Name: dimethyl-[3-[(2S,5R)-5-phenyl-2-propan-2-yl-1,3-oxazolidin-3-ium-3-yl]propyl]azanium Openeye Name: 3-[(2S,5R)-2-isopropyl-5-phenyl-oxazolidin-3-ium-3-yl]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[(2S,5R)-5-phenyl-2-propan-2-yl-3-oxazolidin-3-iumyl]propyl]ammonium IUPAC Name: dimethyl-[3-[(2S,5R)-5-phenyl-2-propan-2-yl-1,3-oxazolidin-3-ium-3-yl]propyl]azanium Traditional Name: 3-[(2S,5R)-2-isopropyl-5-phenyl-oxazolidin-3-ium-3-yl]propyl-dimethyl-ammonium Formula: C17H30N2O+2 MolecularWeight: 278.4329

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1[NH+](CC(O1)C2=CC=CC=C2)CCC[NH+](C)C

Isomeric SMILES

CC(C)[C@H]1[NH+](C[C@H](O1)C2=CC=CC=C2)CCC[NH+](C)C

InChI

InChI=1S/C17H28N2O/c1-14(2)17-19(12-8-11-18(3)4)13-16(20-17)15-9-6-5-7-10-15/h5-7,9-10,14,16-17H,8,11-13H2,1-4H3/p+2/t16-,17-/m0/s1