[3-(4-methoxy-4-oxidanylidene-butyl)-7-methyl-6,8-bis(oxidanylidene)-5-phenyl-isochromen-7-yl] cyclopentanecarboxylate

Systemtic Name: [3-(4-methoxy-4-oxidanylidene-butyl)-7-methyl-6,8-bis(oxidanylidene)-5-phenyl-isochromen-7-yl] cyclopentanecarboxylate Openeye Name: [3-(4-methoxy-4-oxo-butyl)-7-methyl-6,8-dioxo-5-phenyl-isochromen-7-yl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-5-phenyl-2-benzopyran-7-yl] ester IUPAC Name: [3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-5-phenylisochromen-7-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [6,8-diketo-3-(4-keto-4-methoxy-butyl)-7-methyl-5-phenyl-isochromen-7-yl] ester Formula: C27H28O7 MolecularWeight: 464.50702

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=COC(=CC2=C(C1=O)C3=CC=CC=C3)CCCC(=O)OC)OC(=O)C4CCCC4

Isomeric SMILES

CC1(C(=O)C2=COC(=CC2=C(C1=O)C3=CC=CC=C3)CCCC(=O)OC)OC(=O)C4CCCC4

InChI

InChI=1S/C27H28O7/c1-27(34-26(31)18-11-6-7-12-18)24(29)21-16-33-19(13-8-14-22(28)32-2)15-20(21)23(25(27)30)17-9-4-3-5-10-17/h3-5,9-10,15-16,18H,6-8,11-14H2,1-2H3