methyl 4-[7-methyl-6,8-bis(oxidanylidene)-7-(3-phenylpropanoyloxy)isochromen-3-yl]butanoate

Systemtic Name: methyl 4-[7-methyl-6,8-bis(oxidanylidene)-7-(3-phenylpropanoyloxy)isochromen-3-yl]butanoate Openeye Name: methyl 4-[7-methyl-6,8-dioxo-7-(3-phenylpropanoyloxy)isochromen-3-yl]butanoate CAS Name: 4-[7-methyl-6,8-dioxo-7-(1-oxo-3-phenylpropoxy)-2-benzopyran-3-yl]butanoic acid methyl ester IUPAC Name: methyl 4-[7-methyl-6,8-dioxo-7-(3-phenylpropanoyloxy)isochromen-3-yl]butanoate Traditional Name: 4-(7-hydrocinnamoyloxy-6,8-diketo-7-methyl-isochromen-3-yl)butyric acid methyl ester Formula: C24H24O7 MolecularWeight: 424.44316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C2C=C(OC=C2C1=O)CCCC(=O)OC)OC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1(C(=O)C=C2C=C(OC=C2C1=O)CCCC(=O)OC)OC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C24H24O7/c1-24(31-22(27)12-11-16-7-4-3-5-8-16)20(25)14-17-13-18(9-6-10-21(26)29-2)30-15-19(17)23(24)28/h3-5,7-8,13-15H,6,9-12H2,1-2H3