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tetrabutyl triphenylene-2,3,6,10-tetracarboxylate

tetrabutyl triphenylene-2,3,6,10-tetracarboxylate

Systemtic Name:tetrabutyl triphenylene-2,3,6,10-tetracarboxylate
Openeye Name:tetrabutyl triphenylene-2,3,6,10-tetracarboxylate
CAS Name:triphenylene-2,3,6,10-tetracarboxylic acid tetrabutyl ester
IUPAC Name:tetrabutyl triphenylene-2,3,6,10-tetracarboxylate
Traditional Name:triphenylene-2,3,6,10-tetracarboxylic acid tetrabutyl ester
Formula: C38H44O8
MolecularWeight: 628.75116
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)C3=CC(=C(C=C3C4=C2C=CC(=C4)C(=O)OCCCC)C(=O)OCCCC)C(=O)OCCCC


Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)C3=CC(=C(C=C3C4=C2C=CC(=C4)C(=O)OCCCC)C(=O)OCCCC)C(=O)OCCCC


InChI

InChI=1S/C38H44O8/c1-5-9-17-43-35(39)25-14-16-28-29(21-25)27-15-13-26(36(40)44-18-10-6-2)22-30(27)32-24-34(38(42)46-20-12-8-4)33(23-31(28)32)37(41)45-19-11-7-3/h13-16,21-24H,5-12,17-20H2,1-4H3


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