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

Systemtic Name: (E)-5-(4-pyridin-2-ylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one Openeye Name: (E)-5-[4-(2-pyridyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one CAS Name: (E)-5-[4-(2-pyridinyl)-1-piperazinyl]-1-(3,4,5-trimethoxyphenyl)-1-penten-3-one IUPAC Name: (E)-5-(4-pyridin-2-ylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one Traditional Name: (E)-5-[4-(2-pyridyl)piperazino]-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)CCN2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)CCN2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C23H29N3O4/c1-28-20-16-18(17-21(29-2)23(20)30-3)7-8-19(27)9-11-25-12-14-26(15-13-25)22-6-4-5-10-24-22/h4-8,10,16-17H,9,11-15H2,1-3H3/b8-7+