(2S)-2-(2-nitropyridin-3-yl)oxy-1-(2,4,5-trimethylphenyl)propan-1-one

Systemtic Name: (2S)-2-(2-nitropyridin-3-yl)oxy-1-(2,4,5-trimethylphenyl)propan-1-one Openeye Name: (2S)-2-[(2-nitro-3-pyridyl)oxy]-1-(2,4,5-trimethylphenyl)propan-1-one CAS Name: (2S)-2-[(2-nitro-3-pyridinyl)oxy]-1-(2,4,5-trimethylphenyl)-1-propanone IUPAC Name: (2S)-2-(2-nitropyridin-3-yl)oxy-1-(2,4,5-trimethylphenyl)propan-1-one Traditional Name: (2S)-2-[(2-nitro-3-pyridyl)oxy]-1-(2,4,5-trimethylphenyl)propan-1-one Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)OC2=C(N=CC=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)[C@H](C)OC2=C(N=CC=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H18N2O4/c1-10-8-12(3)14(9-11(10)2)16(20)13(4)23-15-6-5-7-18-17(15)19(21)22/h5-9,13H,1-4H3/t13-/m0/s1