N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-4-nitro-phenoxy)butanamide

Systemtic Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-4-nitro-phenoxy)butanamide Openeye Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-4-nitro-phenoxy)butanamide CAS Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-4-nitrophenoxy)butanamide IUPAC Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-4-nitrophenoxy)butanamide Traditional Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-4-nitro-phenoxy)butyramide Formula: C21H26N2O6 MolecularWeight: 402.44094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O6/c1-6-18(29-16-8-9-17(23(25)26)13(2)11-16)21(24)22-14(3)15-7-10-19(27-4)20(12-15)28-5/h7-12,14,18H,6H2,1-5H3,(H,22,24)