(E)-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]-3-(2,4,5-trimethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-asaryl-N-[(2-pyrrolidino-4-pyridyl)methyl]acrylamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)NCC2=CC(=NC=C2)N3CCCC3)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-27-18-14-20(29-3)19(28-2)13-17(18)6-7-22(26)24-15-16-8-9-23-21(12-16)25-10-4-5-11-25/h6-9,12-14H,4-5,10-11,15H2,1-3H3,(H,24,26)/b7-6+