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

Systemtic Name: 3H-1,3-benzoxazol-2-ylidene-(3-butyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)azanium Openeye Name: 3H-1,3-benzoxazol-2-ylidene-(3-butyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)ammonium CAS Name: 3H-1,3-benzoxazol-2-ylidene-(3-butyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)ammonium IUPAC Name: 3H-1,3-benzoxazol-2-ylidene-(3-butyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)azanium Traditional Name: 3H-1,3-benzoxazol-2-ylidene-(3-butyl-1,2,3,4-tetrahydro-s-triazin-3-ium-6-yl)ammonium Formula: C14H21N5O+2 MolecularWeight: 275.34944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N5O/c1-2-3-8-19-9-15-13(16-10-19)18-14-17-11-6-4-5-7-12(11)20-14/h4-7H,2-3,8-10H2,1H3,(H2,15,16,17,18)/p+2