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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F)OC

InChI

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