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

Systemtic Name: [(1S)-1-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)ethyl]azanium Openeye Name: [(1S)-1-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)ethyl]ammonium CAS Name: [(1S)-1-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)ethyl]ammonium IUPAC Name: [(1S)-1-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)ethyl]azanium Traditional Name: [(1S)-1-(3-keto-4-propyl-1,4-benzoxazin-6-yl)ethyl]ammonium Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O2/c1-3-6-15-11-7-10(9(2)14)4-5-12(11)17-8-13(15)16/h4-5,7,9H,3,6,8,14H2,1-2H3/p+1/t9-/m0/s1