ethyl-methoxy-methyl-[(3R)-4-oxidanyl-4-oxidanylidene-3-(phenylmethyl)butanoyl]azanium

Systemtic Name: ethyl-methoxy-methyl-[(3R)-4-oxidanyl-4-oxidanylidene-3-(phenylmethyl)butanoyl]azanium Openeye Name: [(3R)-3-benzyl-4-hydroxy-4-oxo-butanoyl]-ethyl-methoxy-methyl-ammonium CAS Name: ethyl-[(3R)-4-hydroxy-1,4-dioxo-3-(phenylmethyl)butyl]-methoxy-methylammonium IUPAC Name: [(3R)-3-benzyl-4-hydroxy-4-oxobutanoyl]-ethyl-methoxy-methylazanium Traditional Name: [(3R)-3-benzyl-4-hydroxy-4-keto-butanoyl]-ethyl-methoxy-methyl-ammonium Formula: C15H22NO4+ MolecularWeight: 280.33948

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C(=O)CC(CC1=CC=CC=C1)C(=O)O)OC

Isomeric SMILES

CC[N+](C)(C(=O)C[C@@H](CC1=CC=CC=C1)C(=O)O)OC

InChI

InChI=1S/C15H21NO4/c1-4-16(2,20-3)14(17)11-13(15(18)19)10-12-8-6-5-7-9-12/h5-9,13H,4,10-11H2,1-3H3/p+1/t13-,16?/m1/s1