4-[(E)-1-[4-[(4-fluorophenyl)methyl]phenyl]-3-piperazin-1-yl-prop-1-enyl]-2-methoxy-phenol

Systemtic Name: 4-[(E)-1-[4-[(4-fluorophenyl)methyl]phenyl]-3-piperazin-1-yl-prop-1-enyl]-2-methoxy-phenol Openeye Name: 4-[(E)-1-[4-[(4-fluorophenyl)methyl]phenyl]-3-piperazin-1-yl-prop-1-enyl]-2-methoxy-phenol CAS Name: 4-[(E)-1-[4-[(4-fluorophenyl)methyl]phenyl]-3-(1-piperazinyl)prop-1-enyl]-2-methoxyphenol IUPAC Name: 4-[(E)-1-[4-[(4-fluorophenyl)methyl]phenyl]-3-piperazin-1-ylprop-1-enyl]-2-methoxyphenol Traditional Name: 4-[(E)-1-[4-(4-fluorobenzyl)phenyl]-3-piperazino-prop-1-enyl]-2-methoxy-phenol Formula: C27H29FN2O2 MolecularWeight: 432.529763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=CCN2CCNCC2)C3=CC=C(C=C3)CC4=CC=C(C=C4)F)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C(=C/CN2CCNCC2)/C3=CC=C(C=C3)CC4=CC=C(C=C4)F)O

InChI

InChI=1S/C27H29FN2O2/c1-32-27-19-23(8-11-26(27)31)25(12-15-30-16-13-29-14-17-30)22-6-2-20(3-7-22)18-21-4-9-24(28)10-5-21/h2-12,19,29,31H,13-18H2,1H3/b25-12+