calcium; hydride; 2-oxidanyl-3-pentadecyl-benzoate

Systemtic Name: calcium; hydride; 2-oxidanyl-3-pentadecyl-benzoate Openeye Name: calcium; hydride; 2-hydroxy-3-pentadecyl-benzoate CAS Name: calcium; hydride; 2-hydroxy-3-pentadecylbenzoate IUPAC Name: calcium; hydride; 2-hydroxy-3-pentadecylbenzoate Traditional Name: calcium; hydride; 2-hydroxy-3-pentadecyl-benzoate Formula: C22H36CaO3 MolecularWeight: 388.59744

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Descriptors Computed from Structure

Canonical SMILES:

[H-].CCCCCCCCCCCCCCCC1=CC=CC(=C1O)C(=O)[O-].[Ca+2]

Isomeric SMILES

[H-].CCCCCCCCCCCCCCCC1=CC=CC(=C1O)C(=O)[O-].[Ca+2]

InChI

InChI=1S/C22H36O3.Ca.H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(21(19)23)22(24)25;;/h15,17-18,23H,2-14,16H2,1H3,(H,24,25);;/q;+2;-1/p-1