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

Systemtic Name: [3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-methyl-2-oxidanylidene-chromen-7-yl] 4-chloranyl-2-nitro-benzoate Openeye Name: [3-[(2-chloro-6-fluoro-phenyl)methyl]-4-methyl-2-oxo-chromen-7-yl] 4-chloro-2-nitro-benzoate CAS Name: 4-chloro-2-nitrobenzoic acid [3-[(2-chloro-6-fluorophenyl)methyl]-4-methyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-[(2-chloro-6-fluorophenyl)methyl]-4-methyl-2-oxochromen-7-yl] 4-chloro-2-nitrobenzoate Traditional Name: 4-chloro-2-nitro-benzoic acid [3-(2-chloro-6-fluoro-benzyl)-2-keto-4-methyl-chromen-7-yl] ester Formula: C24H14Cl2FNO6 MolecularWeight: 502.275463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C24H14Cl2FNO6/c1-12-15-8-6-14(33-23(29)16-7-5-13(25)9-21(16)28(31)32)10-22(15)34-24(30)17(12)11-18-19(26)3-2-4-20(18)27/h2-10H,11H2,1H3