1-[(R)-[(2R)-2-ethyl-3-methyl-3-nitro-butyl]sulfinyl]-4-methyl-benzene

Systemtic Name: 1-[(R)-[(2R)-2-ethyl-3-methyl-3-nitro-butyl]sulfinyl]-4-methyl-benzene Openeye Name: 1-[(R)-[(2R)-2-ethyl-3-methyl-3-nitro-butyl]sulfinyl]-4-methyl-benzene CAS Name: 1-[(R)-[(2R)-2-ethyl-3-methyl-3-nitrobutyl]sulfinyl]-4-methylbenzene IUPAC Name: 1-[(R)-[(2R)-2-ethyl-3-methyl-3-nitrobutyl]sulfinyl]-4-methylbenzene Traditional Name: 1-[(R)-[(2R)-2-ethyl-3-methyl-3-nitro-butyl]sulfinyl]-4-methyl-benzene Formula: C14H21NO3S MolecularWeight: 283.38644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CS(=O)C1=CC=C(C=C1)C)C(C)(C)[N+](=O)[O-]

Isomeric SMILES

CC[C@@H](C[S@@](=O)C1=CC=C(C=C1)C)C(C)(C)[N+](=O)[O-]

InChI

InChI=1S/C14H21NO3S/c1-5-12(14(3,4)15(16)17)10-19(18)13-8-6-11(2)7-9-13/h6-9,12H,5,10H2,1-4H3/t12-,19+/m0/s1