[4-(2-azanylpropanoyl)piperazin-1-yl] fluoranylmethanesulfinate

Systemtic Name: [4-(2-azanylpropanoyl)piperazin-1-yl] fluoranylmethanesulfinate Openeye Name: [4-(2-aminopropanoyl)piperazin-1-yl] fluoromethanesulfinate CAS Name: fluoromethanesulfinic acid [4-(2-amino-1-oxopropyl)-1-piperazinyl] ester IUPAC Name: [4-(2-aminopropanoyl)piperazin-1-yl] fluoromethanesulfinate Traditional Name: fluoromethanesulfinic acid (4-alanylpiperazino) ester Formula: C8H16FN3O3S MolecularWeight: 253.294343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)OS(=O)CF)N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)OS(=O)CF)N

InChI

InChI=1S/C8H16FN3O3S/c1-7(10)8(13)11-2-4-12(5-3-11)15-16(14)6-9/h7H,2-6,10H2,1H3