hexyl 3-[5-(2-fluoranyl-1H-inden-1-yl)-2-(methylamino)-4-oxidanylidene-furan-3-yl]benzoate

Systemtic Name: hexyl 3-[5-(2-fluoranyl-1H-inden-1-yl)-2-(methylamino)-4-oxidanylidene-furan-3-yl]benzoate Openeye Name: hexyl 3-[5-(2-fluoro-1H-inden-1-yl)-2-(methylamino)-4-oxo-3-furyl]benzoate CAS Name: 3-[5-(2-fluoro-1H-inden-1-yl)-2-(methylamino)-4-oxo-3-furanyl]benzoic acid hexyl ester IUPAC Name: hexyl 3-[5-(2-fluoro-1H-inden-1-yl)-2-(methylamino)-4-oxofuran-3-yl]benzoate Traditional Name: 3-[5-(2-fluoro-1H-inden-1-yl)-4-keto-2-(methylamino)-3-furyl]benzoic acid hexyl ester Formula: C27H28FNO4 MolecularWeight: 449.513923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=CC(=C1)C2=C(OC(C2=O)C3C4=CC=CC=C4C=C3F)NC

Isomeric SMILES

CCCCCCOC(=O)C1=CC=CC(=C1)C2=C(OC(C2=O)C3C4=CC=CC=C4C=C3F)NC

InChI

InChI=1S/C27H28FNO4/c1-3-4-5-8-14-32-27(31)19-12-9-11-18(15-19)22-24(30)25(33-26(22)29-2)23-20-13-7-6-10-17(20)16-21(23)28/h6-7,9-13,15-16,23,25,29H,3-5,8,14H2,1-2H3