2-(2-methylpiperazin-1-yl)-5-octadecoxy-pentanoate

Systemtic Name: 2-(2-methylpiperazin-1-yl)-5-octadecoxy-pentanoate Openeye Name: 2-(2-methylpiperazin-1-yl)-5-octadecoxy-pentanoate CAS Name: 2-(2-methyl-1-piperazinyl)-5-octadecoxypentanoate IUPAC Name: 2-(2-methylpiperazin-1-yl)-5-octadecoxypentanoate Traditional Name: 2-(2-methylpiperazino)-5-stearyloxy-valerate Formula: C28H55N2O3- MolecularWeight: 467.7479

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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)/p-1