(E)-3-(2,5-dimethoxyphenyl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(2,5-dimethoxyphenyl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]prop-2-enamide Openeye Name: (E)-3-(2,5-dimethoxyphenyl)-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]prop-2-enamide CAS Name: (E)-3-(2,5-dimethoxyphenyl)-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]-2-propenamide IUPAC Name: (E)-3-(2,5-dimethoxyphenyl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]prop-2-enamide Traditional Name: (E)-3-(2,5-dimethoxyphenyl)-N-[(6-pyrrolidino-3-pyridyl)methyl]acrylamide Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)NCC2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)/C=C/C(=O)NCC2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C21H25N3O3/c1-26-18-7-8-19(27-2)17(13-18)6-10-21(25)23-15-16-5-9-20(22-14-16)24-11-3-4-12-24/h5-10,13-14H,3-4,11-12,15H2,1-2H3,(H,23,25)/b10-6+