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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)COC2=C(OC3=C(C2=O)C=C(C=C3)Cl)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)COC2=C(OC3=C(C2=O)C=C(C=C3)Cl)C4=CC=C(C=C4)C

InChI

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