[3-(2-chloranyl-6-fluoranyl-phenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] 3-benzamidopropanoate

Systemtic Name: [3-(2-chloranyl-6-fluoranyl-phenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] 3-benzamidopropanoate Openeye Name: [3-(2-chloro-6-fluoro-phenyl)-2-methyl-4-oxo-chromen-7-yl] 3-benzamidopropanoate CAS Name: 3-benzamidopropanoic acid [3-(2-chloro-6-fluorophenyl)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-chloro-6-fluorophenyl)-2-methyl-4-oxochromen-7-yl] 3-benzamidopropanoate Traditional Name: 3-benzamidopropionic acid [3-(2-chloro-6-fluoro-phenyl)-4-keto-2-methyl-chromen-7-yl] ester Formula: C26H19ClFNO5 MolecularWeight: 479.884163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)CCNC(=O)C3=CC=CC=C3)C4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)CCNC(=O)C3=CC=CC=C3)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C26H19ClFNO5/c1-15-23(24-19(27)8-5-9-20(24)28)25(31)18-11-10-17(14-21(18)33-15)34-22(30)12-13-29-26(32)16-6-3-2-4-7-16/h2-11,14H,12-13H2,1H3,(H,29,32)