2-(1H-imidazol-2-ylmethyl)-4-methyl-3-oxidanidyl-quinazolin-3-ium

Systemtic Name: 2-(1H-imidazol-2-ylmethyl)-4-methyl-3-oxidanidyl-quinazolin-3-ium Openeye Name: 2-(1H-imidazol-2-ylmethyl)-4-methyl-3-oxido-quinazolin-3-ium CAS Name: 2-(1H-imidazol-2-ylmethyl)-4-methyl-3-oxidoquinazolin-3-ium IUPAC Name: 2-(1H-imidazol-2-ylmethyl)-4-methyl-3-oxidoquinazolin-3-ium Traditional Name: 2-(1H-imidazol-2-ylmethyl)-4-methyl-3-oxido-quinazolin-3-ium Formula: C13H12N4O MolecularWeight: 240.26058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=NC2=CC=CC=C12)CC3=NC=CN3)[O-]

Isomeric SMILES

CC1=[N+](C(=NC2=CC=CC=C12)CC3=NC=CN3)[O-]

InChI

InChI=1S/C13H12N4O/c1-9-10-4-2-3-5-11(10)16-13(17(9)18)8-12-14-6-7-15-12/h2-7H,8H2,1H3,(H,14,15)