(2S,6S)-2,3-dimethyl-6-(4-nitrophenyl)piperidin-4-one

Systemtic Name: (2S,6S)-2,3-dimethyl-6-(4-nitrophenyl)piperidin-4-one Openeye Name: (2S,6S)-2,3-dimethyl-6-(4-nitrophenyl)piperidin-4-one CAS Name: (2S,6S)-2,3-dimethyl-6-(4-nitrophenyl)-4-piperidinone IUPAC Name: (2S,6S)-2,3-dimethyl-6-(4-nitrophenyl)piperidin-4-one Traditional Name: (2S,6S)-2,3-dimethyl-6-(4-nitrophenyl)-4-piperidone Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(CC1=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1C(C(=O)C[C@H](N1)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H16N2O3/c1-8-9(2)14-12(7-13(8)16)10-3-5-11(6-4-10)15(17)18/h3-6,8-9,12,14H,7H2,1-2H3/t8?,9-,12-/m0/s1