cyclopentyl-[2-oxidanyl-3-[[2-(trifluoromethyl)phenyl]carbamoylamino]chromen-4-ylidene]azanium

Systemtic Name: cyclopentyl-[2-oxidanyl-3-[[2-(trifluoromethyl)phenyl]carbamoylamino]chromen-4-ylidene]azanium Openeye Name: cyclopentyl-[2-hydroxy-3-[[2-(trifluoromethyl)phenyl]carbamoylamino]chromen-4-ylidene]ammonium CAS Name: cyclopentyl-[2-hydroxy-3-[[oxo-[2-(trifluoromethyl)anilino]methyl]amino]-1-benzopyran-4-ylidene]ammonium IUPAC Name: cyclopentyl-[2-hydroxy-3-[[2-(trifluoromethyl)phenyl]carbamoylamino]chromen-4-ylidene]azanium Traditional Name: cyclopentyl-[2-hydroxy-3-[[2-(trifluoromethyl)phenyl]carbamoylamino]chromen-4-ylidene]ammonium Formula: C22H21F3N3O3+ MolecularWeight: 432.41565

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NC4=CC=CC=C4C(F)(F)F)O

Isomeric SMILES

C1CCC(C1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NC4=CC=CC=C4C(F)(F)F)O

InChI

InChI=1S/C22H20F3N3O3/c23-22(24,25)15-10-4-5-11-16(15)27-21(30)28-19-18(26-13-7-1-2-8-13)14-9-3-6-12-17(14)31-20(19)29/h3-6,9-13,29H,1-2,7-8H2,(H2,27,28,30)/p+1