2-methyl-3-octadecyl-butanedioic acid

Systemtic Name: 2-methyl-3-octadecyl-butanedioic acid Openeye Name: 2-methyl-3-octadecyl-butanedioic acid CAS Name: 2-methyl-3-octadecylbutanedioic acid IUPAC Name: 2-methyl-3-octadecylbutanedioic acid Traditional Name: 2-methyl-3-stearyl-succinic acid Formula: C23H44O4 MolecularWeight: 384.59306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C(C)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C(C)C(=O)O)C(=O)O

InChI

InChI=1S/C23H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(23(26)27)20(2)22(24)25/h20-21H,3-19H2,1-2H3,(H,24,25)(H,26,27)