(2S)-N-(2-bromanyl-4-methyl-phenyl)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-propanamide

Systemtic Name: (2S)-N-(2-bromanyl-4-methyl-phenyl)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-propanamide Openeye Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]propanamide CAS Name: (2S)-N-(2-bromo-4-methylphenyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]propanamide IUPAC Name: (2S)-N-(2-bromo-4-methylphenyl)-2-(6-methyl-2-nitropyridin-3-yl)oxypropanamide Traditional Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]propionamide Formula: C16H16BrN3O4 MolecularWeight: 394.21994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)OC2=C(N=C(C=C2)C)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C)OC2=C(N=C(C=C2)C)[N+](=O)[O-])Br

InChI

InChI=1S/C16H16BrN3O4/c1-9-4-6-13(12(17)8-9)19-16(21)11(3)24-14-7-5-10(2)18-15(14)20(22)23/h4-8,11H,1-3H3,(H,19,21)/t11-/m0/s1