2-(16-methylheptadecoxycarbonyl)cyclohexane-1-carboxylic acid

Systemtic Name: 2-(16-methylheptadecoxycarbonyl)cyclohexane-1-carboxylic acid Openeye Name: 2-(16-methylheptadecoxycarbonyl)cyclohexanecarboxylic acid CAS Name: 2-[16-methylheptadecoxy(oxo)methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-(16-methylheptadecoxycarbonyl)cyclohexane-1-carboxylic acid Traditional Name: 2-(16-methylheptadecoxycarbonyl)cyclohexanecarboxylic acid Formula: C26H48O4 MolecularWeight: 424.65692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)O

InChI

InChI=1S/C26H48O4/c1-22(2)18-14-12-10-8-6-4-3-5-7-9-11-13-17-21-30-26(29)24-20-16-15-19-23(24)25(27)28/h22-24H,3-21H2,1-2H3,(H,27,28)