6-methyl-4-[2-(2H-1,2,3,4-tetrazol-5-yl)ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-methyl-4-[2-(2H-1,2,3,4-tetrazol-5-yl)ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-methyl-4-[2-(2H-tetrazol-5-yl)ethyl]-1,4-benzoxazin-3-one CAS Name: 6-methyl-4-[2-(2H-tetrazol-5-yl)ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-methyl-4-[2-(2H-tetrazol-5-yl)ethyl]-1,4-benzoxazin-3-one Traditional Name: 6-methyl-4-[2-(2H-tetrazol-5-yl)ethyl]-1,4-benzoxazin-3-one Formula: C12H13N5O2 MolecularWeight: 259.26392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2CCC3=NNN=N3

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2CCC3=NNN=N3

InChI

InChI=1S/C12H13N5O2/c1-8-2-3-10-9(6-8)17(12(18)7-19-10)5-4-11-13-15-16-14-11/h2-3,6H,4-5,7H2,1H3,(H,13,14,15,16)