N-[(4-fluorophenyl)methyl]-4-(3-methylbut-2-enoyl)piperazine-1-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-(3-methylbut-2-enoyl)piperazine-1-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-4-(3-methylbut-2-enoyl)piperazine-1-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-4-(3-methyl-1-oxobut-2-enyl)-1-piperazinecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-4-(3-methylbut-2-enoyl)piperazine-1-carboxamide Traditional Name: N-(4-fluorobenzyl)-4-(3-methylbut-2-enoyl)piperazine-1-carboxamide Formula: C17H22FN3O2 MolecularWeight: 319.373883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)C(=O)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CC(=CC(=O)N1CCN(CC1)C(=O)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H22FN3O2/c1-13(2)11-16(22)20-7-9-21(10-8-20)17(23)19-12-14-3-5-15(18)6-4-14/h3-6,11H,7-10,12H2,1-2H3,(H,19,23)