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

Systemtic Name: [(1S)-1-[4-(2-hydroxyethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[4-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[4-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[4-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[4-(2-hydroxyethyl)-3-keto-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C13H19N2O3+ MolecularWeight: 251.30156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CCO)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CCO)[NH3+]

InChI

InChI=1S/C13H18N2O3/c1-2-10(14)9-3-4-12-11(7-9)15(5-6-16)13(17)8-18-12/h3-4,7,10,16H,2,5-6,8,14H2,1H3/p+1/t10-/m0/s1