N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-fluoranyl-benzamide Openeye Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]-3-fluoro-benzamide CAS Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-3-fluorobenzamide IUPAC Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-3-fluorobenzamide Traditional Name: 3-fluoro-N-[2-methyl-1-(4-piperonylpiperazine-1-carbonyl)propyl]benzamide Formula: C24H28FN3O4 MolecularWeight: 441.495223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H28FN3O4/c1-16(2)22(26-23(29)18-4-3-5-19(25)13-18)24(30)28-10-8-27(9-11-28)14-17-6-7-20-21(12-17)32-15-31-20/h3-7,12-13,16,22H,8-11,14-15H2,1-2H3,(H,26,29)