(2S)-2-[(1R)-1-(4-methylphenyl)-2-nitro-ethyl]cyclohexan-1-one

Systemtic Name: (2S)-2-[(1R)-1-(4-methylphenyl)-2-nitro-ethyl]cyclohexan-1-one Openeye Name: (2S)-2-[(1R)-2-nitro-1-(p-tolyl)ethyl]cyclohexanone CAS Name: (2S)-2-[(1R)-1-(4-methylphenyl)-2-nitroethyl]-1-cyclohexanone IUPAC Name: (2S)-2-[(1R)-1-(4-methylphenyl)-2-nitroethyl]cyclohexan-1-one Traditional Name: (2S)-2-[(1R)-2-nitro-1-(p-tolyl)ethyl]cyclohexanone Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[N+](=O)[O-])C2CCCCC2=O

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[N+](=O)[O-])[C@@H]2CCCCC2=O

InChI

InChI=1S/C15H19NO3/c1-11-6-8-12(9-7-11)14(10-16(18)19)13-4-2-3-5-15(13)17/h6-9,13-14H,2-5,10H2,1H3/t13-,14-/m0/s1