[3-heptyl-7-methyl-6,8-bis(oxidanylidene)isochromen-7-yl] decanoate

Systemtic Name: [3-heptyl-7-methyl-6,8-bis(oxidanylidene)isochromen-7-yl] decanoate Openeye Name: (3-heptyl-7-methyl-6,8-dioxo-isochromen-7-yl) decanoate CAS Name: decanoic acid (3-heptyl-7-methyl-6,8-dioxo-2-benzopyran-7-yl) ester IUPAC Name: (3-heptyl-7-methyl-6,8-dioxoisochromen-7-yl) decanoate Traditional Name: capric acid (3-heptyl-6,8-diketo-7-methyl-isochromen-7-yl) ester Formula: C27H40O5 MolecularWeight: 444.6035

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1(C(=O)C=C2C=C(OC=C2C1=O)CCCCCCC)C

Isomeric SMILES

CCCCCCCCCC(=O)OC1(C(=O)C=C2C=C(OC=C2C1=O)CCCCCCC)C

InChI

InChI=1S/C27H40O5/c1-4-6-8-10-11-13-15-17-25(29)32-27(3)24(28)19-21-18-22(16-14-12-9-7-5-2)31-20-23(21)26(27)30/h18-20H,4-17H2,1-3H3