1-[3,4-bis(fluoranyl)phenyl]-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide Openeye Name: 1-(3,4-difluorophenyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide CAS Name: 1-(3,4-difluorophenyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)-4-piperidinecarboxamide IUPAC Name: 1-(3,4-difluorophenyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide Traditional Name: 1-(3,4-difluorophenyl)-N-(3-keto-4H-1,4-benzoxazin-6-yl)isonipecotamide Formula: C20H19F2N3O3 MolecularWeight: 387.379966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C20H19F2N3O3/c21-15-3-2-14(10-16(15)22)25-7-5-12(6-8-25)20(27)23-13-1-4-18-17(9-13)24-19(26)11-28-18/h1-4,9-10,12H,5-8,11H2,(H,23,27)(H,24,26)