7-[(2R,6R)-2,6-dimethylpiperazin-4-ium-1-yl]-3-ethyl-1,3-benzoxazol-2-one

Systemtic Name: 7-[(2R,6R)-2,6-dimethylpiperazin-4-ium-1-yl]-3-ethyl-1,3-benzoxazol-2-one Openeye Name: 7-[(2R,6R)-2,6-dimethylpiperazin-4-ium-1-yl]-3-ethyl-1,3-benzoxazol-2-one CAS Name: 7-[(2R,6R)-2,6-dimethyl-1-piperazin-4-iumyl]-3-ethyl-1,3-benzoxazol-2-one IUPAC Name: 7-[(2R,6R)-2,6-dimethylpiperazin-4-ium-1-yl]-3-ethyl-1,3-benzoxazol-2-one Traditional Name: 7-[(2R,6R)-2,6-dimethylpiperazin-4-ium-1-yl]-3-ethyl-1,3-benzoxazol-2-one Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=CC=C2)N3C(C[NH2+]CC3C)C)OC1=O

Isomeric SMILES

CCN1C2=C(C(=CC=C2)N3[C@@H](C[NH2+]C[C@H]3C)C)OC1=O

InChI

InChI=1S/C15H21N3O2/c1-4-17-12-6-5-7-13(14(12)20-15(17)19)18-10(2)8-16-9-11(18)3/h5-7,10-11,16H,4,8-9H2,1-3H3/p+1/t10-,11-/m1/s1