cyclohexyl 2-(2-methyl-4-nitro-imidazol-1-yl)ethanoate

Systemtic Name: cyclohexyl 2-(2-methyl-4-nitro-imidazol-1-yl)ethanoate Openeye Name: cyclohexyl 2-(2-methyl-4-nitro-imidazol-1-yl)acetate CAS Name: 2-(2-methyl-4-nitro-1-imidazolyl)acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(2-methyl-4-nitroimidazol-1-yl)acetate Traditional Name: 2-(2-methyl-4-nitro-imidazol-1-yl)acetic acid cyclohexyl ester Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1CC(=O)OC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CN1CC(=O)OC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4/c1-9-13-11(15(17)18)7-14(9)8-12(16)19-10-5-3-2-4-6-10/h7,10H,2-6,8H2,1H3