[(1R)-1-[(2S)-2-methyl-3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl]propyl]azanium

Systemtic Name: [(1R)-1-[(2S)-2-methyl-3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1R)-1-[(2S)-2-methyl-3-oxo-4-propyl-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1R)-1-[(2S)-2-methyl-3-oxo-4-propyl-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1R)-1-[(2S)-2-methyl-3-oxo-4-propyl-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1R)-1-[(2S)-3-keto-2-methyl-4-propyl-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(CC)[NH3+])OC(C1=O)C

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)[C@@H](CC)[NH3+])O[C@H](C1=O)C

InChI

InChI=1S/C15H22N2O2/c1-4-8-17-13-9-11(12(16)5-2)6-7-14(13)19-10(3)15(17)18/h6-7,9-10,12H,4-5,8,16H2,1-3H3/p+1/t10-,12+/m0/s1