[(1R)-1-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)propyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)COC2=C1C=C(C=C2)C(CC)[NH3+]

Isomeric SMILES

CCCN1C(=O)COC2=C1C=C(C=C2)[C@@H](CC)[NH3+]

InChI

InChI=1S/C14H20N2O2/c1-3-7-16-12-8-10(11(15)4-2)5-6-13(12)18-9-14(16)17/h5-6,8,11H,3-4,7,9,15H2,1-2H3/p+1/t11-/m1/s1