[(1R)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]-propyl-azanium

Systemtic Name: [(1R)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]-propyl-azanium Openeye Name: [(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-propyl-ammonium CAS Name: [(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-propylammonium IUPAC Name: [(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-propylazanium Traditional Name: [(1R)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]-propyl-ammonium Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C(C)C1=CC2=C(C=C1)OCC(=O)N2

Isomeric SMILES

CCC[NH2+][C@H](C)C1=CC2=C(C=C1)OCC(=O)N2

InChI

InChI=1S/C13H18N2O2/c1-3-6-14-9(2)10-4-5-12-11(7-10)15-13(16)8-17-12/h4-5,7,9,14H,3,6,8H2,1-2H3,(H,15,16)/p+1/t9-/m1/s1