(4S)-4-[(1S,6S)-3,4-dimethyl-6-nitro-cyclohex-3-en-1-yl]-2,2-dimethyl-1,3-dioxolane

Systemtic Name: (4S)-4-[(1S,6S)-3,4-dimethyl-6-nitro-cyclohex-3-en-1-yl]-2,2-dimethyl-1,3-dioxolane Openeye Name: (4S)-4-[(1S,6S)-3,4-dimethyl-6-nitro-cyclohex-3-en-1-yl]-2,2-dimethyl-1,3-dioxolane CAS Name: (4S)-4-[(1S,6S)-3,4-dimethyl-6-nitro-1-cyclohex-3-enyl]-2,2-dimethyl-1,3-dioxolane IUPAC Name: (4S)-4-[(1S,6S)-3,4-dimethyl-6-nitrocyclohex-3-en-1-yl]-2,2-dimethyl-1,3-dioxolane Traditional Name: (4S)-4-[(1S,6S)-3,4-dimethyl-6-nitro-cyclohex-3-en-1-yl]-2,2-dimethyl-1,3-dioxolane Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C2COC(O2)(C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C[C@@H]([C@H](C1)[C@H]2COC(O2)(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C13H21NO4/c1-8-5-10(11(14(15)16)6-9(8)2)12-7-17-13(3,4)18-12/h10-12H,5-7H2,1-4H3/t10-,11-,12+/m0/s1