(E)-1-(4-pyridin-4-ylpiperazin-1-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-pyridin-4-ylpiperazin-1-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(4-pyridyl)piperazin-1-yl]-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(4-pyridin-4-yl-1-piperazinyl)-3-(2,4,5-trimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-pyridin-4-ylpiperazin-1-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-asaryl-1-[4-(4-pyridyl)piperazino]prop-2-en-1-one Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)N2CCN(CC2)C3=CC=NC=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)N2CCN(CC2)C3=CC=NC=C3)OC)OC

InChI

InChI=1S/C21H25N3O4/c1-26-18-15-20(28-3)19(27-2)14-16(18)4-5-21(25)24-12-10-23(11-13-24)17-6-8-22-9-7-17/h4-9,14-15H,10-13H2,1-3H3/b5-4+