propyl 4-[7-(4-bromophenyl)carbonyloxy-2-methyl-4-oxidanylidene-chromen-3-yl]oxybenzoate

Systemtic Name: propyl 4-[7-(4-bromophenyl)carbonyloxy-2-methyl-4-oxidanylidene-chromen-3-yl]oxybenzoate Openeye Name: propyl 4-[7-(4-bromobenzoyl)oxy-2-methyl-4-oxo-chromen-3-yl]oxybenzoate CAS Name: 4-[[7-[(4-bromophenyl)-oxomethoxy]-2-methyl-4-oxo-1-benzopyran-3-yl]oxy]benzoic acid propyl ester IUPAC Name: propyl 4-[7-(4-bromobenzoyl)oxy-2-methyl-4-oxochromen-3-yl]oxybenzoate Traditional Name: 4-[7-(4-bromobenzoyl)oxy-4-keto-2-methyl-chromen-3-yl]oxybenzoic acid propyl ester Formula: C27H21BrO7 MolecularWeight: 537.35544

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C27H21BrO7/c1-3-14-32-26(30)17-6-10-20(11-7-17)34-25-16(2)33-23-15-21(12-13-22(23)24(25)29)35-27(31)18-4-8-19(28)9-5-18/h4-13,15H,3,14H2,1-2H3