5-[(1S)-2-nitrocyclohex-2-en-1-yl]-1,3-benzodioxole

Systemtic Name: 5-[(1S)-2-nitrocyclohex-2-en-1-yl]-1,3-benzodioxole Openeye Name: 5-[(1S)-2-nitrocyclohex-2-en-1-yl]-1,3-benzodioxole CAS Name: 5-[(1S)-2-nitro-1-cyclohex-2-enyl]-1,3-benzodioxole IUPAC Name: 5-[(1S)-2-nitrocyclohex-2-en-1-yl]-1,3-benzodioxole Traditional Name: 5-[(1S)-2-nitrocyclohex-2-en-1-yl]-1,3-benzodioxole Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C(C1)C2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

C1CC=C([C@@H](C1)C2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C13H13NO4/c15-14(16)11-4-2-1-3-10(11)9-5-6-12-13(7-9)18-8-17-12/h4-7,10H,1-3,8H2/t10-/m0/s1