methyl 4-[[6-chloranyl-7-methyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[6-chloranyl-7-methyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[6-chloro-7-methyl-4-oxo-2-(p-tolyl)chromen-3-yl]oxymethyl]benzoate CAS Name: 4-[[6-chloro-7-methyl-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-chloro-7-methyl-2-(4-methylphenyl)-4-oxochromen-3-yl]oxymethyl]benzoate Traditional Name: 4-[[6-chloro-4-keto-7-methyl-2-(p-tolyl)chromen-3-yl]oxymethyl]benzoic acid methyl ester Formula: C26H21ClO5 MolecularWeight: 448.89494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC(=C(C=C3O2)C)Cl)OCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC(=C(C=C3O2)C)Cl)OCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H21ClO5/c1-15-4-8-18(9-5-15)24-25(23(28)20-13-21(27)16(2)12-22(20)32-24)31-14-17-6-10-19(11-7-17)26(29)30-3/h4-13H,14H2,1-3H3