(2S)-N-(2-bromanyl-4-methyl-phenyl)-2-(2-methoxy-5-nitro-phenoxy)propanamide

Systemtic Name: (2S)-N-(2-bromanyl-4-methyl-phenyl)-2-(2-methoxy-5-nitro-phenoxy)propanamide Openeye Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-(2-methoxy-5-nitro-phenoxy)propanamide CAS Name: (2S)-N-(2-bromo-4-methylphenyl)-2-(2-methoxy-5-nitrophenoxy)propanamide IUPAC Name: (2S)-N-(2-bromo-4-methylphenyl)-2-(2-methoxy-5-nitrophenoxy)propanamide Traditional Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-(2-methoxy-5-nitro-phenoxy)propionamide Formula: C17H17BrN2O5 MolecularWeight: 409.23128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN2O5/c1-10-4-6-14(13(18)8-10)19-17(21)11(2)25-16-9-12(20(22)23)5-7-15(16)24-3/h4-9,11H,1-3H3,(H,19,21)/t11-/m0/s1