[(1S)-1-[4-(2-methylprop-2-enyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium

Systemtic Name: [(1S)-1-[4-(2-methylprop-2-enyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[4-(2-methylallyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[4-(2-methylprop-2-enyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[4-(2-methylprop-2-enyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[3-keto-4-(2-methylallyl)-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C15H21N2O2+ MolecularWeight: 261.33944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CC(=C)C)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC(=C)C)[NH3+]

InChI

InChI=1S/C15H20N2O2/c1-4-12(16)11-5-6-14-13(7-11)17(8-10(2)3)15(18)9-19-14/h5-7,12H,2,4,8-9,16H2,1,3H3/p+1/t12-/m0/s1