7-(4-methyl-4-oxidanidyl-piperazin-4-ium-1-yl)-3H-1,3-benzoxazol-2-one

Systemtic Name: 7-(4-methyl-4-oxidanidyl-piperazin-4-ium-1-yl)-3H-1,3-benzoxazol-2-one Openeye Name: 7-(4-methyl-4-oxido-piperazin-4-ium-1-yl)-3H-1,3-benzoxazol-2-one CAS Name: 7-(4-methyl-4-oxido-1-piperazin-4-iumyl)-3H-1,3-benzoxazol-2-one IUPAC Name: 7-(4-methyl-4-oxidopiperazin-4-ium-1-yl)-3H-1,3-benzoxazol-2-one Traditional Name: 7-(4-methyl-4-oxido-piperazin-4-ium-1-yl)-3H-1,3-benzoxazol-2-one Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2=CC=CC3=C2OC(=O)N3)[O-]

Isomeric SMILES

C[N+]1(CCN(CC1)C2=CC=CC3=C2OC(=O)N3)[O-]

InChI

InChI=1S/C12H15N3O3/c1-15(17)7-5-14(6-8-15)10-4-2-3-9-11(10)18-12(16)13-9/h2-4H,5-8H2,1H3,(H,13,16)