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calcium 2-[(E)-hexadec-2-enyl]butanedioate

calcium 2-[(E)-hexadec-2-enyl]butanedioate

Systemtic Name:calcium 2-[(E)-hexadec-2-enyl]butanedioate
Openeye Name:calcium 2-[(E)-hexadec-2-enyl]butanedioate
CAS Name:calcium 2-[(E)-hexadec-2-enyl]butanedioate
IUPAC Name:calcium 2-[(E)-hexadec-2-enyl]butanedioate
Traditional Name:calcium 2-[(E)-hexadec-2-enyl]succinate
Formula: C20H34CaO4
MolecularWeight: 378.55956
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CCC(CC(=O)[O-])C(=O)[O-].[Ca+2]


Isomeric SMILES

CCCCCCCCCCCCC/C=C/CC(CC(=O)[O-])C(=O)[O-].[Ca+2]


InChI

InChI=1S/C20H36O4.Ca/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20(23)24)17-19(21)22;/h14-15,18H,2-13,16-17H2,1H3,(H,21,22)(H,23,24);/q;+2/p-2/b15-14+;


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