(2S)-2-(azepan-1-yl)-2-(4-fluorophenyl)-1-piperazin-1-yl-ethanone

Systemtic Name: (2S)-2-(azepan-1-yl)-2-(4-fluorophenyl)-1-piperazin-1-yl-ethanone Openeye Name: (2S)-2-(azepan-1-yl)-2-(4-fluorophenyl)-1-piperazin-1-yl-ethanone CAS Name: (2S)-2-(1-azepanyl)-2-(4-fluorophenyl)-1-(1-piperazinyl)ethanone IUPAC Name: (2S)-2-(azepan-1-yl)-2-(4-fluorophenyl)-1-piperazin-1-ylethanone Traditional Name: (2S)-2-(azepan-1-yl)-2-(4-fluorophenyl)-1-piperazino-ethanone Formula: C18H26FN3O MolecularWeight: 319.416943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(C2=CC=C(C=C2)F)C(=O)N3CCNCC3

Isomeric SMILES

C1CCCN(CC1)[C@@H](C2=CC=C(C=C2)F)C(=O)N3CCNCC3

InChI

InChI=1S/C18H26FN3O/c19-16-7-5-15(6-8-16)17(21-11-3-1-2-4-12-21)18(23)22-13-9-20-10-14-22/h5-8,17,20H,1-4,9-14H2/t17-/m0/s1