3H-1,3-benzoxazol-2-ylidene-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)azanium

Systemtic Name: 3H-1,3-benzoxazol-2-ylidene-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)azanium Openeye Name: 3H-1,3-benzoxazol-2-ylidene-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)ammonium CAS Name: 3H-1,3-benzoxazol-2-ylidene-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)ammonium IUPAC Name: 3H-1,3-benzoxazol-2-ylidene-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)azanium Traditional Name: 3H-1,3-benzoxazol-2-ylidene-(3-propyl-1,2,3,4-tetrahydro-s-triazin-3-ium-6-yl)ammonium Formula: C13H19N5O+2 MolecularWeight: 261.32286

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CNC(=NC1)[NH+]=C2NC3=CC=CC=C3O2

Isomeric SMILES

CCC[NH+]1CNC(=NC1)[NH+]=C2NC3=CC=CC=C3O2

InChI

InChI=1S/C13H17N5O/c1-2-7-18-8-14-12(15-9-18)17-13-16-10-5-3-4-6-11(10)19-13/h3-6H,2,7-9H2,1H3,(H2,14,15,16,17)/p+2