trimethyl-[(2S)-2-oxidanyl-4-oxidanylidene-4-phenylmethoxy-butyl]azanium perchlorate

Systemtic Name: trimethyl-[(2S)-2-oxidanyl-4-oxidanylidene-4-phenylmethoxy-butyl]azanium perchlorate Openeye Name: [(2S)-4-benzyloxy-2-hydroxy-4-oxo-butyl]-trimethyl-ammonium perchlorate CAS Name: [(2S)-2-hydroxy-4-oxo-4-phenylmethoxybutyl]-trimethylammonium perchlorate IUPAC Name: [(2S)-2-hydroxy-4-oxo-4-phenylmethoxybutyl]-trimethylazanium perchlorate Traditional Name: [(2S)-4-benzoxy-2-hydroxy-4-keto-butyl]-trimethyl-ammonium perchlorate Formula: C14H22ClNO7 MolecularWeight: 351.77998

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)OCC1=CC=CC=C1)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+](C)(C)C[C@H](CC(=O)OCC1=CC=CC=C1)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C14H22NO3.ClHO4/c1-15(2,3)10-13(16)9-14(17)18-11-12-7-5-4-6-8-12;2-1(3,4)5/h4-8,13,16H,9-11H2,1-3H3;(H,2,3,4,5)/q+1;/p-1/t13-;/m0./s1