trimethyl-[3-[[(2Z)-2-(phenylmethylidene)-1,4-benzoxazin-3-yl]oxy]propyl]azanium

Systemtic Name: trimethyl-[3-[[(2Z)-2-(phenylmethylidene)-1,4-benzoxazin-3-yl]oxy]propyl]azanium Openeye Name: 3-[[(2Z)-2-benzylidene-1,4-benzoxazin-3-yl]oxy]propyl-trimethyl-ammonium CAS Name: trimethyl-[3-[[(2Z)-2-(phenylmethylene)-1,4-benzoxazin-3-yl]oxy]propyl]ammonium IUPAC Name: 3-[[(2Z)-2-benzylidene-1,4-benzoxazin-3-yl]oxy]propyl-trimethylazanium Traditional Name: 3-[[(2Z)-2-benzal-1,4-benzoxazin-3-yl]oxy]propyl-trimethyl-ammonium Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCOC1=NC2=CC=CC=C2OC1=CC3=CC=CC=C3

Isomeric SMILES

C[N+](C)(C)CCCOC\1=NC2=CC=CC=C2O/C1=C\C3=CC=CC=C3

InChI

InChI=1S/C21H25N2O2/c1-23(2,3)14-9-15-24-21-20(16-17-10-5-4-6-11-17)25-19-13-8-7-12-18(19)22-21/h4-8,10-13,16H,9,14-15H2,1-3H3/q+1/b20-16-