[3-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-5-methoxy-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-yl] ethanoate

Systemtic Name: [3-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-5-methoxy-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-yl] ethanoate Openeye Name: [3-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-5-methoxy-1-methyl-3-oxido-imidazolidin-3-ium-4-yl] acetate CAS Name: acetic acid [3-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-5-methoxy-1-methyl-3-oxido-4-imidazolidin-3-iumyl] ester IUPAC Name: [3-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-5-methoxy-1-methyl-3-oxidoimidazolidin-3-ium-4-yl] acetate Traditional Name: acetic acid [3-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)-5-methoxy-1-methyl-3-oxido-imidazolidin-3-ium-4-yl] ester Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(N(C[N+]1(C2=NC3=C(S2)C(=O)CC(C3)(C)C)[O-])C)OC

Isomeric SMILES

CC(=O)OC1C(N(C[N+]1(C2=NC3=C(S2)C(=O)CC(C3)(C)C)[O-])C)OC

InChI

InChI=1S/C16H23N3O5S/c1-9(20)24-14-13(23-5)18(4)8-19(14,22)15-17-10-6-16(2,3)7-11(21)12(10)25-15/h13-14H,6-8H2,1-5H3