[2,2-dimethyl-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]propyl]-dimethyl-azanium

Systemtic Name: [2,2-dimethyl-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]propyl]-dimethyl-azanium Openeye Name: [2,2-dimethyl-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]propyl]-dimethyl-ammonium CAS Name: [2,2-dimethyl-3-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]propyl]-dimethylammonium IUPAC Name: [2,2-dimethyl-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]propyl]-dimethylazanium Traditional Name: [3-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)CCCN1C2=CC=CC=C2OC1=O)C[NH+](C)C

Isomeric SMILES

CC(C)(CNC(=O)CCCN1C2=CC=CC=C2OC1=O)C[NH+](C)C

InChI

InChI=1S/C18H27N3O3/c1-18(2,13-20(3)4)12-19-16(22)10-7-11-21-14-8-5-6-9-15(14)24-17(21)23/h5-6,8-9H,7,10-13H2,1-4H3,(H,19,22)/p+1