1-[[(2S,4S)-2-(2-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl]-2-methyl-5-nitro-imidazole

Systemtic Name: 1-[[(2S,4S)-2-(2-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl]-2-methyl-5-nitro-imidazole Openeye Name: 1-[[(2S,4S)-2-(2-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl]-2-methyl-5-nitro-imidazole CAS Name: 1-[[(2S,4S)-2-(2-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl]-2-methyl-5-nitroimidazole IUPAC Name: 1-[[(2S,4S)-2-(2-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl]-2-methyl-5-nitroimidazole Traditional Name: 1-[[(2S,4S)-2-(2-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl]-2-methyl-5-nitro-imidazole Formula: C15H16ClN3O4 MolecularWeight: 337.75824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CC2COC(O2)(C)C3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1C[C@H]2CO[C@](O2)(C)C3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H16ClN3O4/c1-10-17-7-14(19(20)21)18(10)8-11-9-22-15(2,23-11)12-5-3-4-6-13(12)16/h3-7,11H,8-9H2,1-2H3/t11-,15-/m0/s1