N-(3-fluoranyl-4-methyl-phenyl)-4-methanoyl-piperazine-1-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-4-methanoyl-piperazine-1-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-4-formyl-piperazine-1-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-4-formyl-1-piperazinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-4-formylpiperazine-1-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-4-formyl-piperazine-1-carboxamide Formula: C13H16FN3O2 MolecularWeight: 265.283443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C=O)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C=O)F

InChI

InChI=1S/C13H16FN3O2/c1-10-2-3-11(8-12(10)14)15-13(19)17-6-4-16(9-18)5-7-17/h2-3,8-9H,4-7H2,1H3,(H,15,19)