[(2R)-1-oxidanylbutan-2-yl]-[(1R)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]azanium

Systemtic Name: [(2R)-1-oxidanylbutan-2-yl]-[(1R)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]azanium Openeye Name: [(1R)-1-(hydroxymethyl)propyl]-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium CAS Name: [(2R)-1-hydroxybutan-2-yl]-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium IUPAC Name: [(2R)-1-hydroxybutan-2-yl]-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]azanium Traditional Name: [(1R)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]-[(1R)-1-methylolpropyl]ammonium Formula: C14H21N2O3+ MolecularWeight: 265.32814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3/c1-3-11(7-17)15-9(2)10-4-5-13-12(6-10)16-14(18)8-19-13/h4-6,9,11,15,17H,3,7-8H2,1-2H3,(H,16,18)/p+1/t9-,11-/m1/s1