N-(1,3-benzodioxol-5-ylmethyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxidanylidene-pentanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxidanylidene-pentanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxo-pentanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[4-(2-fluorophenyl)-1-piperazinyl]-5-oxopentanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxopentanamide Traditional Name: 5-[4-(2-fluorophenyl)piperazino]-5-keto-N-piperonyl-valeramide Formula: C23H26FN3O4 MolecularWeight: 427.468643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)CCCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)CCCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H26FN3O4/c24-18-4-1-2-5-19(18)26-10-12-27(13-11-26)23(29)7-3-6-22(28)25-15-17-8-9-20-21(14-17)31-16-30-20/h1-2,4-5,8-9,14H,3,6-7,10-13,15-16H2,(H,25,28)