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2-[(E)-pentacos-6-enyl]butanedioic acid

2-[(E)-pentacos-6-enyl]butanedioic acid

Systemtic Name:2-[(E)-pentacos-6-enyl]butanedioic acid
Openeye Name:2-[(E)-pentacos-6-enyl]butanedioic acid
CAS Name:2-[(E)-pentacos-6-enyl]butanedioic acid
IUPAC Name:2-[(E)-pentacos-6-enyl]butanedioic acid
Traditional Name:2-[(E)-pentacos-6-enyl]succinic acid
Formula: C29H54O4
MolecularWeight: 466.73666
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC=CCCCCCC(CC(=O)O)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCC/C=C/CCCCCC(CC(=O)O)C(=O)O


InChI

InChI=1S/C29H54O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27(29(32)33)26-28(30)31/h19-20,27H,2-18,21-26H2,1H3,(H,30,31)(H,32,33)/b20-19+


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