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

Systemtic Name: hexyl-[(1R)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]azanium Openeye Name: hexyl-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium CAS Name: hexyl-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium IUPAC Name: hexyl-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]azanium Traditional Name: hexyl-[(1R)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2/c1-3-4-5-6-9-17-12(2)13-7-8-15-14(10-13)18-16(19)11-20-15/h7-8,10,12,17H,3-6,9,11H2,1-2H3,(H,18,19)/p+1/t12-/m1/s1