(3S)-3-[(1S)-3-(2-methyl-1,3-dioxolan-2-yl)-1-nitro-propyl]cyclohexan-1-one

Systemtic Name: (3S)-3-[(1S)-3-(2-methyl-1,3-dioxolan-2-yl)-1-nitro-propyl]cyclohexan-1-one Openeye Name: (3S)-3-[(1S)-3-(2-methyl-1,3-dioxolan-2-yl)-1-nitro-propyl]cyclohexanone CAS Name: (3S)-3-[(1S)-3-(2-methyl-1,3-dioxolan-2-yl)-1-nitropropyl]-1-cyclohexanone IUPAC Name: (3S)-3-[(1S)-3-(2-methyl-1,3-dioxolan-2-yl)-1-nitropropyl]cyclohexan-1-one Traditional Name: (3S)-3-[(1S)-3-(2-methyl-1,3-dioxolan-2-yl)-1-nitro-propyl]cyclohexanone Formula: C13H21NO5 MolecularWeight: 271.30954

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CCC(C2CCCC(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CC1(OCCO1)CC[C@@H]([C@H]2CCCC(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C13H21NO5/c1-13(18-7-8-19-13)6-5-12(14(16)17)10-3-2-4-11(15)9-10/h10,12H,2-9H2,1H3/t10-,12-/m0/s1