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4-heptyl-3-(7-methyloctyl)phthalic acid

4-heptyl-3-(7-methyloctyl)phthalic acid

Systemtic Name:4-heptyl-3-(7-methyloctyl)phthalic acid
Openeye Name:4-heptyl-3-(7-methyloctyl)phthalic acid
CAS Name:4-heptyl-3-(7-methyloctyl)phthalic acid
IUPAC Name:4-heptyl-3-(7-methyloctyl)phthalic acid
Traditional Name:4-heptyl-3-(7-methyloctyl)phthalic acid
Formula: C24H38O4
MolecularWeight: 390.55612
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCC(C)C


Isomeric SMILES

CCCCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCC(C)C


InChI

InChI=1S/C24H38O4/c1-4-5-6-7-11-14-19-16-17-21(23(25)26)22(24(27)28)20(19)15-12-9-8-10-13-18(2)3/h16-18H,4-15H2,1-3H3,(H,25,26)(H,27,28)


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