8-methyl-3-propyl-2H-1,3-benzoxazin-3-ium

Systemtic Name: 8-methyl-3-propyl-2H-1,3-benzoxazin-3-ium Openeye Name: 8-methyl-3-propyl-2H-1,3-benzoxazin-3-ium CAS Name: 8-methyl-3-propyl-2H-1,3-benzoxazin-3-ium IUPAC Name: 8-methyl-3-propyl-2H-1,3-benzoxazin-3-ium Traditional Name: 8-methyl-3-propyl-2H-1,3-benzoxazin-3-ium Formula: C12H16NO+ MolecularWeight: 190.26154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC2=C(C(=CC=C2)C)OC1

Isomeric SMILES

CCC[N+]1=CC2=C(C(=CC=C2)C)OC1

InChI

InChI=1S/C12H16NO/c1-3-7-13-8-11-6-4-5-10(2)12(11)14-9-13/h4-6,8H,3,7,9H2,1-2H3/q+1