hexakis(4-propylphenyl) benzene-1,2,3,4,5,6-hexacarboxylate

Systemtic Name: hexakis(4-propylphenyl) benzene-1,2,3,4,5,6-hexacarboxylate Openeye Name: hexakis(4-propylphenyl) benzene-1,2,3,4,5,6-hexacarboxylate CAS Name: benzene-1,2,3,4,5,6-hexacarboxylic acid hexakis(4-propylphenyl) ester IUPAC Name: hexakis(4-propylphenyl) benzene-1,2,3,4,5,6-hexacarboxylate Traditional Name: benzene-1,2,3,4,5,6-hexacarboxylic acid hexakis(4-propylphenyl) ester Formula: C66H66O12 MolecularWeight: 1051.22304

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C(=C2C(=O)OC3=CC=C(C=C3)CCC)C(=O)OC4=CC=C(C=C4)CCC)C(=O)OC5=CC=C(C=C5)CCC)C(=O)OC6=CC=C(C=C6)CCC)C(=O)OC7=CC=C(C=C7)CCC

Isomeric SMILES

CCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C(=C2C(=O)OC3=CC=C(C=C3)CCC)C(=O)OC4=CC=C(C=C4)CCC)C(=O)OC5=CC=C(C=C5)CCC)C(=O)OC6=CC=C(C=C6)CCC)C(=O)OC7=CC=C(C=C7)CCC

InChI

InChI=1S/C66H66O12/c1-7-13-43-19-31-49(32-20-43)73-61(67)55-56(62(68)74-50-33-21-44(14-8-2)22-34-50)58(64(70)76-52-37-25-46(16-10-4)26-38-52)60(66(72)78-54-41-29-48(18-12-6)30-42-54)59(65(71)77-53-39-27-47(17-11-5)28-40-53)57(55)63(69)75-51-35-23-45(15-9-3)24-36-51/h19-42H,7-18H2,1-6H3