[3-[(4-fluorophenyl)methyl]-4-methyl-2-oxidanylidene-chromen-7-yl] 2,5-dimethoxybenzoate

Systemtic Name: [3-[(4-fluorophenyl)methyl]-4-methyl-2-oxidanylidene-chromen-7-yl] 2,5-dimethoxybenzoate Openeye Name: [3-[(4-fluorophenyl)methyl]-4-methyl-2-oxo-chromen-7-yl] 2,5-dimethoxybenzoate CAS Name: 2,5-dimethoxybenzoic acid [3-[(4-fluorophenyl)methyl]-4-methyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-[(4-fluorophenyl)methyl]-4-methyl-2-oxochromen-7-yl] 2,5-dimethoxybenzoate Traditional Name: 2,5-dimethoxybenzoic acid [3-(4-fluorobenzyl)-2-keto-4-methyl-chromen-7-yl] ester Formula: C26H21FO6 MolecularWeight: 448.439743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C3=C(C=CC(=C3)OC)OC)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C3=C(C=CC(=C3)OC)OC)CC4=CC=C(C=C4)F

InChI

InChI=1S/C26H21FO6/c1-15-20-10-8-19(32-26(29)22-13-18(30-2)9-11-23(22)31-3)14-24(20)33-25(28)21(15)12-16-4-6-17(27)7-5-16/h4-11,13-14H,12H2,1-3H3