N-[2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-ethanamide Openeye Name: N-[2-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-oxo-ethyl]-2-phenyl-acetamide CAS Name: N-[2-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-2-oxoethyl]-2-phenylacetamide IUPAC Name: N-[2-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-2-oxoethyl]-2-phenylacetamide Traditional Name: N-[2-[4-(3-fluoro-4-methoxy-benzyl)piperazino]-2-keto-ethyl]-2-phenyl-acetamide Formula: C22H26FN3O3 MolecularWeight: 399.458543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CNC(=O)CC3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CNC(=O)CC3=CC=CC=C3)F

InChI

InChI=1S/C22H26FN3O3/c1-29-20-8-7-18(13-19(20)23)16-25-9-11-26(12-10-25)22(28)15-24-21(27)14-17-5-3-2-4-6-17/h2-8,13H,9-12,14-16H2,1H3,(H,24,27)