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4,5-bis(decoxycarbonyl)phthalic acid

4,5-bis(decoxycarbonyl)phthalic acid

Systemtic Name:4,5-bis(decoxycarbonyl)phthalic acid
Openeye Name:4,5-bis(decoxycarbonyl)phthalic acid
CAS Name:4,5-bis[decoxy(oxo)methyl]phthalic acid
IUPAC Name:4,5-bis(decoxycarbonyl)phthalic acid
Traditional Name:4,5-bis(decoxycarbonyl)phthalic acid
Formula: C30H46O8
MolecularWeight: 534.68144
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)OCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCOC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)OCCCCCCCCCC


InChI

InChI=1S/C30H46O8/c1-3-5-7-9-11-13-15-17-19-37-29(35)25-21-23(27(31)32)24(28(33)34)22-26(25)30(36)38-20-18-16-14-12-10-8-6-4-2/h21-22H,3-20H2,1-2H3,(H,31,32)(H,33,34)


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