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

Systemtic Name: 2-methylpropyl-[(1R)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]azanium Openeye Name: isobutyl-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium CAS Name: 2-methylpropyl-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonium IUPAC Name: 2-methylpropyl-[(1R)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]azanium Traditional Name: isobutyl-[(1R)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]ammonium Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O2/c1-9(2)7-15-10(3)11-4-5-13-12(6-11)16-14(17)8-18-13/h4-6,9-10,15H,7-8H2,1-3H3,(H,16,17)/p+1/t10-/m1/s1