6-bromanyl-2-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]imino-chromene-3-carboxamide

Systemtic Name: 6-bromanyl-2-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]imino-chromene-3-carboxamide Openeye Name: 6-bromo-2-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]imino-chromene-3-carboxamide CAS Name: 6-bromo-2-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]imino-1-benzopyran-3-carboxamide IUPAC Name: 6-bromo-2-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]iminochromene-3-carboxamide Traditional Name: 6-bromo-2-[2-piperidino-5-(trifluoromethyl)phenyl]imino-chromene-3-carboxamide Formula: C22H19BrF3N3O2 MolecularWeight: 494.30437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)N=C3C(=CC4=C(O3)C=CC(=C4)Br)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)N=C3C(=CC4=C(O3)C=CC(=C4)Br)C(=O)N

InChI

InChI=1S/C22H19BrF3N3O2/c23-15-5-7-19-13(10-15)11-16(20(27)30)21(31-19)28-17-12-14(22(24,25)26)4-6-18(17)29-8-2-1-3-9-29/h4-7,10-12H,1-3,8-9H2,(H2,27,30)