4-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one

Systemtic Name: 4-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one Openeye Name: 4-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one CAS Name: 4-methyl-8-(1-piperazin-4-iumyl)-1,4-benzoxazin-3-one IUPAC Name: 4-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one Traditional Name: 4-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one Formula: C13H18N3O2+ MolecularWeight: 248.30092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=CC=C2N3CC[NH2+]CC3

Isomeric SMILES

CN1C(=O)COC2=C1C=CC=C2N3CC[NH2+]CC3

InChI

InChI=1S/C13H17N3O2/c1-15-10-3-2-4-11(13(10)18-9-12(15)17)16-7-5-14-6-8-16/h2-4,14H,5-9H2,1H3/p+1