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

Systemtic Name: 7-[(2S,6S)-2,6-dimethylpiperazin-4-ium-1-yl]-3-methyl-1,3-benzoxazol-2-one Openeye Name: 7-[(2S,6S)-2,6-dimethylpiperazin-4-ium-1-yl]-3-methyl-1,3-benzoxazol-2-one CAS Name: 7-[(2S,6S)-2,6-dimethyl-1-piperazin-4-iumyl]-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 7-[(2S,6S)-2,6-dimethylpiperazin-4-ium-1-yl]-3-methyl-1,3-benzoxazol-2-one Traditional Name: 7-[(2S,6S)-2,6-dimethylpiperazin-4-ium-1-yl]-3-methyl-1,3-benzoxazol-2-one Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH2+]CC(N1C2=CC=CC3=C2OC(=O)N3C)C

Isomeric SMILES

C[C@H]1C[NH2+]C[C@@H](N1C2=CC=CC3=C2OC(=O)N3C)C

InChI

InChI=1S/C14H19N3O2/c1-9-7-15-8-10(2)17(9)12-6-4-5-11-13(12)19-14(18)16(11)3/h4-6,9-10,15H,7-8H2,1-3H3/p+1/t9-,10-/m0/s1