2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]iminomethyl]-4-nitro-phenolate Formula: C15H19N2O3- MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

C[C@H]1CCC[C@H]([C@@H]1C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C15H20N2O3/c1-10-4-3-5-14(11(10)2)16-9-12-8-13(17(19)20)6-7-15(12)18/h6-11,14,18H,3-5H2,1-2H3/p-1/t10-,11+,14+/m0/s1