[(1S)-1-[(2S)-4-butyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]ethyl]azanium

Systemtic Name: [(1S)-1-[(2S)-4-butyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]ethyl]azanium Openeye Name: [(1S)-1-[(2S)-4-butyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium CAS Name: [(1S)-1-[(2S)-4-butyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium IUPAC Name: [(1S)-1-[(2S)-4-butyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]azanium Traditional Name: [(1S)-1-[(2S)-4-butyl-3-keto-2-methyl-1,4-benzoxazin-6-yl]ethyl]ammonium Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)C(C)[NH3+])OC(C1=O)C

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)[C@H](C)[NH3+])O[C@H](C1=O)C

InChI

InChI=1S/C15H22N2O2/c1-4-5-8-17-13-9-12(10(2)16)6-7-14(13)19-11(3)15(17)18/h6-7,9-11H,4-5,8,16H2,1-3H3/p+1/t10-,11-/m0/s1