2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl (E)-3-pyridin-2-ylprop-2-enoate

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl (E)-3-pyridin-2-ylprop-2-enoate Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl (E)-3-(2-pyridyl)prop-2-enoate CAS Name: (E)-3-(2-pyridinyl)-2-propenoic acid 2-[4-(4-fluorophenyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl (E)-3-pyridin-2-ylprop-2-enoate Traditional Name: (E)-3-(2-pyridyl)acrylic acid 2-[4-(4-fluorophenyl)piperazino]ethyl ester Formula: C20H22FN3O2 MolecularWeight: 355.405983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(=O)C=CC2=CC=CC=N2)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1CCOC(=O)/C=C/C2=CC=CC=N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O2/c21-17-4-7-19(8-5-17)24-13-11-23(12-14-24)15-16-26-20(25)9-6-18-3-1-2-10-22-18/h1-10H,11-16H2/b9-6+