[5,7-dimethyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-phenoxybutanoate

Systemtic Name: [5,7-dimethyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-phenoxybutanoate Openeye Name: [5,7-dimethyl-4-oxo-2-(p-tolyl)chromen-3-yl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [5,7-dimethyl-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [5,7-dimethyl-2-(4-methylphenyl)-4-oxochromen-3-yl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [4-keto-5,7-dimethyl-2-(p-tolyl)chromen-3-yl] ester Formula: C28H26O5 MolecularWeight: 442.50304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)C)C)OC(=O)CCCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)C)C)OC(=O)CCCOC4=CC=CC=C4

InChI

InChI=1S/C28H26O5/c1-18-11-13-21(14-12-18)27-28(26(30)25-20(3)16-19(2)17-23(25)32-27)33-24(29)10-7-15-31-22-8-5-4-6-9-22/h4-6,8-9,11-14,16-17H,7,10,15H2,1-3H3