(3-methyl-4-nitro-phenyl) 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (3-methyl-4-nitro-phenyl) 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: (3-methyl-4-nitro-phenyl) 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid (3-methyl-4-nitrophenyl) ester IUPAC Name: (3-methyl-4-nitrophenyl) 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid (3-methyl-4-nitro-phenyl) ester Formula: C19H21NO7 MolecularWeight: 375.37254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)CCC2=CC(=C(C(=C2)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)CCC2=CC(=C(C(=C2)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H21NO7/c1-12-9-14(6-7-15(12)20(22)23)27-18(21)8-5-13-10-16(24-2)19(26-4)17(11-13)25-3/h6-7,9-11H,5,8H2,1-4H3