N-[2-[4-(2,3-dimethoxyphenyl)carbonylpiperazin-1-yl]ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(2,3-dimethoxyphenyl)carbonylpiperazin-1-yl]ethyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[4-(2,3-dimethoxybenzoyl)piperazin-1-yl]ethyl]-4-fluoro-benzamide CAS Name: N-[2-[4-[(2,3-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]ethyl]-4-fluorobenzamide IUPAC Name: N-[2-[4-(2,3-dimethoxybenzoyl)piperazin-1-yl]ethyl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-[2-(4-o-veratroylpiperazino)ethyl]benzamide Formula: C22H26FN3O4 MolecularWeight: 415.457943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O4/c1-29-19-5-3-4-18(20(19)30-2)22(28)26-14-12-25(13-15-26)11-10-24-21(27)16-6-8-17(23)9-7-16/h3-9H,10-15H2,1-2H3,(H,24,27)