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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutanamide Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-4-keto-N-piperonyl-butyramide Formula: C22H24FN3O4 MolecularWeight: 413.442063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H24FN3O4/c23-17-2-4-18(5-3-17)25-9-11-26(12-10-25)22(28)8-7-21(27)24-14-16-1-6-19-20(13-16)30-15-29-19/h1-6,13H,7-12,14-15H2,(H,24,27)