[7-methyl-3-(2-methyl-6-oxidanyl-phenyl)-6,8-bis(oxidanylidene)isochromen-7-yl] (E)-2-methyloct-2-enoate

Systemtic Name: [7-methyl-3-(2-methyl-6-oxidanyl-phenyl)-6,8-bis(oxidanylidene)isochromen-7-yl] (E)-2-methyloct-2-enoate Openeye Name: [3-(2-hydroxy-6-methyl-phenyl)-7-methyl-6,8-dioxo-isochromen-7-yl] (E)-2-methyloct-2-enoate CAS Name: (E)-2-methyl-2-octenoic acid [3-(2-hydroxy-6-methylphenyl)-7-methyl-6,8-dioxo-2-benzopyran-7-yl] ester IUPAC Name: [3-(2-hydroxy-6-methylphenyl)-7-methyl-6,8-dioxoisochromen-7-yl] (E)-2-methyloct-2-enoate Traditional Name: (E)-2-methyloct-2-enoic acid [3-(2-hydroxy-6-methyl-phenyl)-6,8-diketo-7-methyl-isochromen-7-yl] ester Formula: C26H28O6 MolecularWeight: 436.49692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=C(C)C(=O)OC1(C(=O)C=C2C=C(OC=C2C1=O)C3=C(C=CC=C3O)C)C

Isomeric SMILES

CCCCC/C=C(\C)/C(=O)OC1(C(=O)C=C2C=C(OC=C2C1=O)C3=C(C=CC=C3O)C)C

InChI

InChI=1S/C26H28O6/c1-5-6-7-8-10-17(3)25(30)32-26(4)22(28)14-18-13-21(31-15-19(18)24(26)29)23-16(2)11-9-12-20(23)27/h9-15,27H,5-8H2,1-4H3/b17-10+