methyl (E)-3-(3,4-dimethoxyphenyl)-2-[(4-methyl-2-nitro-phenoxy)methyl]prop-2-enoate

Systemtic Name: methyl (E)-3-(3,4-dimethoxyphenyl)-2-[(4-methyl-2-nitro-phenoxy)methyl]prop-2-enoate Openeye Name: methyl (E)-3-(3,4-dimethoxyphenyl)-2-[(4-methyl-2-nitro-phenoxy)methyl]prop-2-enoate CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-[(4-methyl-2-nitrophenoxy)methyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(3,4-dimethoxyphenyl)-2-[(4-methyl-2-nitrophenoxy)methyl]prop-2-enoate Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-2-[(4-methyl-2-nitro-phenoxy)methyl]acrylic acid methyl ester Formula: C20H21NO7 MolecularWeight: 387.38324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=CC2=CC(=C(C=C2)OC)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO7/c1-13-5-7-17(16(9-13)21(23)24)28-12-15(20(22)27-4)10-14-6-8-18(25-2)19(11-14)26-3/h5-11H,12H2,1-4H3/b15-10+