[(1S)-1-(4-butyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-2-methoxy-ethyl]azanium

Systemtic Name: [(1S)-1-(4-butyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-2-methoxy-ethyl]azanium Openeye Name: [(1S)-1-(4-butyl-3-oxo-1,4-benzoxazin-6-yl)-2-methoxy-ethyl]ammonium CAS Name: [(1S)-1-(4-butyl-3-oxo-1,4-benzoxazin-6-yl)-2-methoxyethyl]ammonium IUPAC Name: [(1S)-1-(4-butyl-3-oxo-1,4-benzoxazin-6-yl)-2-methoxyethyl]azanium Traditional Name: [(1S)-1-(4-butyl-3-keto-1,4-benzoxazin-6-yl)-2-methoxy-ethyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)COC2=C1C=C(C=C2)C(COC)[NH3+]

Isomeric SMILES

CCCCN1C(=O)COC2=C1C=C(C=C2)[C@@H](COC)[NH3+]

InChI

InChI=1S/C15H22N2O3/c1-3-4-7-17-13-8-11(12(16)9-19-2)5-6-14(13)20-10-15(17)18/h5-6,8,12H,3-4,7,9-10,16H2,1-2H3/p+1/t12-/m1/s1