2-(2-methylpiperazin-1-yl)-5-octadecoxy-pentanoic acid

Systemtic Name: 2-(2-methylpiperazin-1-yl)-5-octadecoxy-pentanoic acid Openeye Name: 2-(2-methylpiperazin-1-yl)-5-octadecoxy-pentanoic acid CAS Name: 2-(2-methyl-1-piperazinyl)-5-octadecoxypentanoic acid IUPAC Name: 2-(2-methylpiperazin-1-yl)-5-octadecoxypentanoic acid Traditional Name: 2-(2-methylpiperazino)-5-stearyloxy-valeric acid Formula: C28H56N2O3 MolecularWeight: 468.75584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCCC(C(=O)O)N1CCNCC1C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCCC(C(=O)O)N1CCNCC1C

InChI

InChI=1S/C28H56N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-33-24-19-20-27(28(31)32)30-22-21-29-25-26(30)2/h26-27,29H,3-25H2,1-2H3,(H,31,32)