(2S,4S)-4-methyl-2-[(1R)-1-naphthalen-1-yl-2-nitro-ethyl]cyclohexan-1-one

Systemtic Name: (2S,4S)-4-methyl-2-[(1R)-1-naphthalen-1-yl-2-nitro-ethyl]cyclohexan-1-one Openeye Name: (2S,4S)-4-methyl-2-[(1R)-1-(1-naphthyl)-2-nitro-ethyl]cyclohexanone CAS Name: (2S,4S)-4-methyl-2-[(1R)-1-(1-naphthalenyl)-2-nitroethyl]-1-cyclohexanone IUPAC Name: (2S,4S)-4-methyl-2-[(1R)-1-naphthalen-1-yl-2-nitroethyl]cyclohexan-1-one Traditional Name: (2S,4S)-4-methyl-2-[(1R)-1-(1-naphthyl)-2-nitro-ethyl]cyclohexanone Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)C(C1)C(C[N+](=O)[O-])C2=CC=CC3=CC=CC=C32

Isomeric SMILES

C[C@H]1CCC(=O)[C@@H](C1)[C@@H](C[N+](=O)[O-])C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C19H21NO3/c1-13-9-10-19(21)17(11-13)18(12-20(22)23)16-8-4-6-14-5-2-3-7-15(14)16/h2-8,13,17-18H,9-12H2,1H3/t13-,17-,18-/m0/s1