(2S)-4-ethyl-2-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one

Systemtic Name: (2S)-4-ethyl-2-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one Openeye Name: (2S)-4-ethyl-2-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one CAS Name: (2S)-4-ethyl-2-methyl-8-(1-piperazin-4-iumyl)-1,4-benzoxazin-3-one IUPAC Name: (2S)-4-ethyl-2-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one Traditional Name: (2S)-4-ethyl-2-methyl-8-piperazin-4-ium-1-yl-1,4-benzoxazin-3-one Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=CC=C2)N3CC[NH2+]CC3)OC(C1=O)C

Isomeric SMILES

CCN1C2=C(C(=CC=C2)N3CC[NH2+]CC3)O[C@H](C1=O)C

InChI

InChI=1S/C15H21N3O2/c1-3-18-13-6-4-5-12(17-9-7-16-8-10-17)14(13)20-11(2)15(18)19/h4-6,11,16H,3,7-10H2,1-2H3/p+1/t11-/m0/s1