2-(2-bromophenyl)-2-[[(1S,2R)-2-nitrocyclohexyl]methyl]-1,3-dioxolane

Systemtic Name: 2-(2-bromophenyl)-2-[[(1S,2R)-2-nitrocyclohexyl]methyl]-1,3-dioxolane Openeye Name: 2-(2-bromophenyl)-2-[[(1S,2R)-2-nitrocyclohexyl]methyl]-1,3-dioxolane CAS Name: 2-(2-bromophenyl)-2-[[(1S,2R)-2-nitrocyclohexyl]methyl]-1,3-dioxolane IUPAC Name: 2-(2-bromophenyl)-2-[[(1S,2R)-2-nitrocyclohexyl]methyl]-1,3-dioxolane Traditional Name: 2-(2-bromophenyl)-2-[[(1S,2R)-2-nitrocyclohexyl]methyl]-1,3-dioxolane Formula: C16H20BrNO4 MolecularWeight: 370.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CC2(OCCO2)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@@H](C1)CC2(OCCO2)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C16H20BrNO4/c17-14-7-3-2-6-13(14)16(21-9-10-22-16)11-12-5-1-4-8-15(12)18(19)20/h2-3,6-7,12,15H,1,4-5,8-11H2/t12-,15+/m0/s1