(2S)-2-[(R)-dimethylamino-(4-nitrophenyl)methyl]cyclohexan-1-one

Systemtic Name: (2S)-2-[(R)-dimethylamino-(4-nitrophenyl)methyl]cyclohexan-1-one Openeye Name: (2S)-2-[(R)-dimethylamino-(4-nitrophenyl)methyl]cyclohexanone CAS Name: (2S)-2-[(R)-dimethylamino-(4-nitrophenyl)methyl]-1-cyclohexanone IUPAC Name: (2S)-2-[(R)-dimethylamino-(4-nitrophenyl)methyl]cyclohexan-1-one Traditional Name: (2S)-2-[(R)-dimethylamino-(4-nitrophenyl)methyl]cyclohexanone Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(C1CCCCC1=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)[C@H]([C@@H]1CCCCC1=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O3/c1-16(2)15(13-5-3-4-6-14(13)18)11-7-9-12(10-8-11)17(19)20/h7-10,13,15H,3-6H2,1-2H3/t13-,15+/m1/s1