4-[(3,5-dimethylphenoxy)methyl]-N-(2-methoxy-4-nitro-phenyl)thiophene-2-carboxamide

Systemtic Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(2-methoxy-4-nitro-phenyl)thiophene-2-carboxamide Openeye Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(2-methoxy-4-nitro-phenyl)thiophene-2-carboxamide CAS Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(2-methoxy-4-nitrophenyl)-2-thiophenecarboxamide IUPAC Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(2-methoxy-4-nitrophenyl)thiophene-2-carboxamide Traditional Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(2-methoxy-4-nitro-phenyl)thiophene-2-carboxamide Formula: C21H20N2O5S MolecularWeight: 412.4589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=CSC(=C2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=CSC(=C2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC)C

InChI

InChI=1S/C21H20N2O5S/c1-13-6-14(2)8-17(7-13)28-11-15-9-20(29-12-15)21(24)22-18-5-4-16(23(25)26)10-19(18)27-3/h4-10,12H,11H2,1-3H3,(H,22,24)