[6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [6-chloro-4-oxo-2-(p-tolyl)chromen-3-yl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [6-chloro-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(4-methylphenyl)-4-oxochromen-3-yl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [6-chloro-4-keto-2-(p-tolyl)chromen-3-yl] ester Formula: C25H17ClO6 MolecularWeight: 448.85188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)C4COC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)C4COC5=CC=CC=C5O4

InChI

InChI=1S/C25H17ClO6/c1-14-6-8-15(9-7-14)23-24(22(27)17-12-16(26)10-11-18(17)31-23)32-25(28)21-13-29-19-4-2-3-5-20(19)30-21/h2-12,21H,13H2,1H3