[3-[(4-bromanyl-2-fluoranyl-phenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]-propyl-azanium

Systemtic Name: [3-[(4-bromanyl-2-fluoranyl-phenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]-propyl-azanium Openeye Name: [3-[(4-bromo-2-fluoro-phenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]-propyl-ammonium CAS Name: [3-[[(4-bromo-2-fluoroanilino)-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]-propylammonium IUPAC Name: [3-[(4-bromo-2-fluorophenyl)carbamoylamino]-2-hydroxychromen-4-ylidene]-propylazanium Traditional Name: [3-[(4-bromo-2-fluoro-phenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]-propyl-ammonium Formula: C19H18BrFN3O3+ MolecularWeight: 435.266923

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]=C1C2=CC=CC=C2OC(=C1NC(=O)NC3=C(C=C(C=C3)Br)F)O

Isomeric SMILES

CCC[NH+]=C1C2=CC=CC=C2OC(=C1NC(=O)NC3=C(C=C(C=C3)Br)F)O

InChI

InChI=1S/C19H17BrFN3O3/c1-2-9-22-16-12-5-3-4-6-15(12)27-18(25)17(16)24-19(26)23-14-8-7-11(20)10-13(14)21/h3-8,10,25H,2,9H2,1H3,(H2,23,24,26)/p+1