(2S)-N-(2,4-dimethylphenyl)-2-(2-methanoyl-4-nitro-phenoxy)propanamide

Systemtic Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-methanoyl-4-nitro-phenoxy)propanamide Openeye Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-formyl-4-nitro-phenoxy)propanamide CAS Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-formyl-4-nitrophenoxy)propanamide IUPAC Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-formyl-4-nitrophenoxy)propanamide Traditional Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-formyl-4-nitro-phenoxy)propionamide Formula: C18H18N2O5 MolecularWeight: 342.34592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5/c1-11-4-6-16(12(2)8-11)19-18(22)13(3)25-17-7-5-15(20(23)24)9-14(17)10-21/h4-10,13H,1-3H3,(H,19,22)/t13-/m0/s1