1-[(2S)-3-ethyl-2-methyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl]ethanone

Systemtic Name: 1-[(2S)-3-ethyl-2-methyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl]ethanone Openeye Name: 1-[(2S)-3-ethyl-2-methyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl]ethanone CAS Name: 1-[(2S)-3-ethyl-2-methyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl]ethanone IUPAC Name: 1-[(2S)-3-ethyl-2-methyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl]ethanone Traditional Name: 1-[(2S)-3-ethyl-2-methyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl]ethanone Formula: C13H18NO2+ MolecularWeight: 220.28752

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC2=C(C=CC(=C2)C(=O)C)OC1C

Isomeric SMILES

CC[NH+]1CC2=C(C=CC(=C2)C(=O)C)O[C@H]1C

InChI

InChI=1S/C13H17NO2/c1-4-14-8-12-7-11(9(2)15)5-6-13(12)16-10(14)3/h5-7,10H,4,8H2,1-3H3/p+1/t10-/m0/s1