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3,5,6-tris[(E)-hept-1-enyl]benzene-1,2,4-tricarboxylic acid

3,5,6-tris[(E)-hept-1-enyl]benzene-1,2,4-tricarboxylic acid

Systemtic Name:3,5,6-tris[(E)-hept-1-enyl]benzene-1,2,4-tricarboxylic acid
Openeye Name:3,5,6-tris[(E)-hept-1-enyl]benzene-1,2,4-tricarboxylic acid
CAS Name:3,5,6-tris[(E)-hept-1-enyl]benzene-1,2,4-tricarboxylic acid
IUPAC Name:3,5,6-tris[(E)-hept-1-enyl]benzene-1,2,4-tricarboxylic acid
Traditional Name:3,5,6-tris[(E)-hept-1-enyl]trimellitic acid
Formula: C30H42O6
MolecularWeight: 498.65088
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC1=C(C(=C(C(=C1C(=O)O)C=CCCCCC)C(=O)O)C(=O)O)C=CCCCCC


Isomeric SMILES

CCCCC/C=C/C1=C(C(=C(C(=C1C(=O)O)/C=C/CCCCC)C(=O)O)C(=O)O)/C=C/CCCCC


InChI

InChI=1S/C30H42O6/c1-4-7-10-13-16-19-22-23(20-17-14-11-8-5-2)26(29(33)34)27(30(35)36)24(25(22)28(31)32)21-18-15-12-9-6-3/h16-21H,4-15H2,1-3H3,(H,31,32)(H,33,34)(H,35,36)/b19-16+,20-17+,21-18+


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