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

Systemtic Name: propyl 4-[[6-chloranyl-7-methyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C28H25ClO5 MolecularWeight: 476.9481

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)COC2=C(OC3=CC(=C(C=C3C2=O)Cl)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)COC2=C(OC3=CC(=C(C=C3C2=O)Cl)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H25ClO5/c1-4-13-32-28(31)21-11-7-19(8-12-21)16-33-27-25(30)22-15-23(29)18(3)14-24(22)34-26(27)20-9-5-17(2)6-10-20/h5-12,14-15H,4,13,16H2,1-3H3