ethyl 4-[[8-bromanyl-2,2-dimethyl-4-(4-methylphenyl)chromen-6-yl]carbonylamino]-2-fluoranyl-benzoate

Systemtic Name: ethyl 4-[[8-bromanyl-2,2-dimethyl-4-(4-methylphenyl)chromen-6-yl]carbonylamino]-2-fluoranyl-benzoate Openeye Name: ethyl 4-[[8-bromo-2,2-dimethyl-4-(p-tolyl)chromene-6-carbonyl]amino]-2-fluoro-benzoate CAS Name: 4-[[[8-bromo-2,2-dimethyl-4-(4-methylphenyl)-1-benzopyran-6-yl]-oxomethyl]amino]-2-fluorobenzoic acid ethyl ester IUPAC Name: ethyl 4-[[8-bromo-2,2-dimethyl-4-(4-methylphenyl)chromene-6-carbonyl]amino]-2-fluorobenzoate Traditional Name: 4-[[8-bromo-2,2-dimethyl-4-(p-tolyl)chromene-6-carbonyl]amino]-2-fluoro-benzoic acid ethyl ester Formula: C28H25BrFNO4 MolecularWeight: 538.404803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)NC(=O)C2=CC(=C3C(=C2)C(=CC(O3)(C)C)C4=CC=C(C=C4)C)Br)F

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)NC(=O)C2=CC(=C3C(=C2)C(=CC(O3)(C)C)C4=CC=C(C=C4)C)Br)F

InChI

InChI=1S/C28H25BrFNO4/c1-5-34-27(33)20-11-10-19(14-24(20)30)31-26(32)18-12-21-22(17-8-6-16(2)7-9-17)15-28(3,4)35-25(21)23(29)13-18/h6-15H,5H2,1-4H3,(H,31,32)