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

Systemtic Name: [(1R)-2-methoxy-1-[4-(methoxymethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]ethyl]azanium Openeye Name: [(1R)-2-methoxy-1-[4-(methoxymethyl)-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium CAS Name: [(1R)-2-methoxy-1-[4-(methoxymethyl)-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium IUPAC Name: [(1R)-2-methoxy-1-[4-(methoxymethyl)-3-oxo-1,4-benzoxazin-6-yl]ethyl]azanium Traditional Name: [(1R)-1-[3-keto-4-(methoxymethyl)-1,4-benzoxazin-6-yl]-2-methoxy-ethyl]ammonium Formula: C13H19N2O4+ MolecularWeight: 267.30096

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Descriptors Computed from Structure

Canonical SMILES:

COCC(C1=CC2=C(C=C1)OCC(=O)N2COC)[NH3+]

Isomeric SMILES

COC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2COC)[NH3+]

InChI

InChI=1S/C13H18N2O4/c1-17-6-10(14)9-3-4-12-11(5-9)15(8-18-2)13(16)7-19-12/h3-5,10H,6-8,14H2,1-2H3/p+1/t10-/m0/s1