(2S)-2-[(1R)-2-nitro-1-phenyl-ethyl]cycloheptan-1-one

Systemtic Name: (2S)-2-[(1R)-2-nitro-1-phenyl-ethyl]cycloheptan-1-one Openeye Name: (2S)-2-[(1R)-2-nitro-1-phenyl-ethyl]cycloheptanone CAS Name: (2S)-2-[(1R)-2-nitro-1-phenylethyl]-1-cycloheptanone IUPAC Name: (2S)-2-[(1R)-2-nitro-1-phenylethyl]cycloheptan-1-one Traditional Name: (2S)-2-[(1R)-2-nitro-1-phenyl-ethyl]cycloheptanone Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)CC1)C(C[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

C1CC[C@H](C(=O)CC1)[C@@H](C[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C15H19NO3/c17-15-10-6-2-5-9-13(15)14(11-16(18)19)12-7-3-1-4-8-12/h1,3-4,7-8,13-14H,2,5-6,9-11H2/t13-,14-/m0/s1