[6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 3,4,5-trimethoxybenzoate Openeye Name: [6-chloro-4-oxo-2-(p-tolyl)chromen-3-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [6-chloro-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(4-methylphenyl)-4-oxochromen-3-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [6-chloro-4-keto-2-(p-tolyl)chromen-3-yl] ester Formula: C26H21ClO7 MolecularWeight: 480.89374

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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)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C26H21ClO7/c1-14-5-7-15(8-6-14)23-25(22(28)18-13-17(27)9-10-19(18)33-23)34-26(29)16-11-20(30-2)24(32-4)21(12-16)31-3/h5-13H,1-4H3