2-(3-fluoranyl-4-methoxy-phenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]ethanamide

Systemtic Name: 2-(3-fluoranyl-4-methoxy-phenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]ethanamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(3-fluoro-4-methoxy-phenyl)acetamide CAS Name: 2-(3-fluoro-4-methoxyphenyl)-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]acetamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(3-fluoro-4-methoxyphenyl)acetamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-2-(3-fluoro-4-methoxy-phenyl)acetamide Formula: C23H30FN3O2 MolecularWeight: 399.501603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)F

InChI

InChI=1S/C23H30FN3O2/c1-29-22-9-8-20(16-21(22)24)17-23(28)25-10-5-11-26-12-14-27(15-13-26)18-19-6-3-2-4-7-19/h2-4,6-9,16H,5,10-15,17-18H2,1H3,(H,25,28)