[(1S,2R,3S)-5-methylidene-3-nitro-2-propan-2-yl-cyclopentyl]sulfonylbenzene

Systemtic Name: [(1S,2R,3S)-5-methylidene-3-nitro-2-propan-2-yl-cyclopentyl]sulfonylbenzene Openeye Name: [(1S,2R,3S)-2-isopropyl-5-methylene-3-nitro-cyclopentyl]sulfonylbenzene CAS Name: [(1S,2R,3S)-5-methylene-3-nitro-2-propan-2-ylcyclopentyl]sulfonylbenzene IUPAC Name: [(1S,2R,3S)-5-methylidene-3-nitro-2-propan-2-ylcyclopentyl]sulfonylbenzene Traditional Name: [(1S,2R,3S)-2-isopropyl-5-methylene-3-nitro-cyclopentyl]sulfonylbenzene Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(CC(=C)C1S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H]1[C@H](CC(=C)[C@H]1S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19NO4S/c1-10(2)14-13(16(17)18)9-11(3)15(14)21(19,20)12-7-5-4-6-8-12/h4-8,10,13-15H,3,9H2,1-2H3/t13-,14+,15+/m0/s1