calcium octadecyl 2-oxidanylbenzoate

Systemtic Name: calcium octadecyl 2-oxidanylbenzoate Openeye Name: calcium octadecyl 2-hydroxybenzoate CAS Name: calcium 2-hydroxybenzoic acid octadecyl ester IUPAC Name: calcium octadecyl 2-hydroxybenzoate Traditional Name: calcium 2-hydroxybenzoic acid stearyl ester Formula: C25H42CaO3+2 MolecularWeight: 430.67718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1O.[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1O.[Ca+2]

InChI

InChI=1S/C25H42O3.Ca/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-28-25(27)23-20-17-18-21-24(23)26;/h17-18,20-21,26H,2-16,19,22H2,1H3;/q;+2