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

Systemtic Name: N-[2-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]ethyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]ethyl]-4-fluoro-benzamide CAS Name: N-[2-[4-[(3,4-dimethylphenyl)-oxomethyl]-1-piperazinyl]ethyl]-4-fluorobenzamide IUPAC Name: N-[2-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]ethyl]-4-fluorobenzamide Traditional Name: N-[2-[4-(3,4-dimethylbenzoyl)piperazino]ethyl]-4-fluoro-benzamide Formula: C22H26FN3O2 MolecularWeight: 383.459143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H26FN3O2/c1-16-3-4-19(15-17(16)2)22(28)26-13-11-25(12-14-26)10-9-24-21(27)18-5-7-20(23)8-6-18/h3-8,15H,9-14H2,1-2H3,(H,24,27)