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

Systemtic Name: 2-hydroxyethyl-[(1S)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]azanium Openeye Name: 2-hydroxyethyl-[(1S)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium CAS Name: 2-hydroxyethyl-[(1S)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium IUPAC Name: 2-hydroxyethyl-[(1S)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]azanium Traditional Name: 2-hydroxyethyl-[(1S)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]ammonium Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c1-8(13-4-5-15)9-2-3-11-10(6-9)14-12(16)7-17-11/h2-3,6,8,13,15H,4-5,7H2,1H3,(H,14,16)/p+1/t8-/m0/s1