calcium (E)-octadec-9-enoate chloride

Systemtic Name: calcium (E)-octadec-9-enoate chloride Openeye Name: calcium (E)-octadec-9-enoate chloride CAS Name: calcium (E)-9-octadecenoate chloride IUPAC Name: calcium (E)-octadec-9-enoate chloride Traditional Name: calcium (E)-octadec-9-enoate chloride Formula: C18H33CaClO2 MolecularWeight: 356.98442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)[O-].[Cl-].[Ca+2]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)[O-].[Cl-].[Ca+2]

InChI

InChI=1S/C18H34O2.Ca.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;;/h9-10H,2-8,11-17H2,1H3,(H,19,20);;1H/q;+2;/p-2/b10-9+;;