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

Systemtic Name: dimethyl-[3-[[(1S)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]azaniumyl]propyl]azanium Openeye Name: dimethyl-[3-[[(1S)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonio]propyl]ammonium CAS Name: dimethyl-[3-[[(1S)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]ammonio]propyl]ammonium IUPAC Name: dimethyl-[3-[[(1S)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]azaniumyl]propyl]azanium Traditional Name: 3-[[(1S)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]ammonio]propyl-dimethyl-ammonium Formula: C15H25N3O2+2 MolecularWeight: 279.3779

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O2/c1-11(16-7-4-8-18(2)3)12-5-6-14-13(9-12)17-15(19)10-20-14/h5-6,9,11,16H,4,7-8,10H2,1-3H3,(H,17,19)/p+2/t11-/m0/s1