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2-(6,7-diphenyltridecyl)propanedioic acid

2-(6,7-diphenyltridecyl)propanedioic acid

Systemtic Name:2-(6,7-diphenyltridecyl)propanedioic acid
Openeye Name:2-(6,7-diphenyltridecyl)propanedioic acid
CAS Name:2-(6,7-diphenyltridecyl)propanedioic acid
IUPAC Name:2-(6,7-diphenyltridecyl)propanedioic acid
Traditional Name:2-(6,7-diphenyltridecyl)malonic acid
Formula: C28H38O4
MolecularWeight: 438.59892
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=CC=C1)C(CCCCCC(C(=O)O)C(=O)O)C2=CC=CC=C2


Isomeric SMILES

CCCCCCC(C1=CC=CC=C1)C(CCCCCC(C(=O)O)C(=O)O)C2=CC=CC=C2


InChI

InChI=1S/C28H38O4/c1-2-3-4-12-19-24(22-15-8-5-9-16-22)25(23-17-10-6-11-18-23)20-13-7-14-21-26(27(29)30)28(31)32/h5-6,8-11,15-18,24-26H,2-4,7,12-14,19-21H2,1H3,(H,29,30)(H,31,32)


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