bis[2-methyl-4-(2-methylhex-5-en-3-yn-2-yl)phenyl] benzene-1,2-dicarboxylate

Systemtic Name: bis[2-methyl-4-(2-methylhex-5-en-3-yn-2-yl)phenyl] benzene-1,2-dicarboxylate Openeye Name: bis[4-(1,1-dimethylpent-4-en-2-ynyl)-2-methyl-phenyl] benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis[2-methyl-4-(2-methylhex-5-en-3-yn-2-yl)phenyl] ester IUPAC Name: bis[2-methyl-4-(2-methylhex-5-en-3-yn-2-yl)phenyl] benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis[4-(1,1-dimethylpent-4-en-2-ynyl)-2-methyl-phenyl] ester Formula: C36H34O4 MolecularWeight: 530.65276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C#CC=C)OC(=O)C2=CC=CC=C2C(=O)OC3=C(C=C(C=C3)C(C)(C)C#CC=C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C#CC=C)OC(=O)C2=CC=CC=C2C(=O)OC3=C(C=C(C=C3)C(C)(C)C#CC=C)C

InChI

InChI=1S/C36H34O4/c1-9-11-21-35(5,6)27-17-19-31(25(3)23-27)39-33(37)29-15-13-14-16-30(29)34(38)40-32-20-18-28(24-26(32)4)36(7,8)22-12-10-2/h9-10,13-20,23-24H,1-2H2,3-8H3