1-[4-(2-hydroxyethyl)piperazin-1-yl]icosa-5,8,11-triyn-1-one

Systemtic Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]icosa-5,8,11-triyn-1-one Openeye Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]icosa-5,8,11-triyn-1-one CAS Name: 1-[4-(2-hydroxyethyl)-1-piperazinyl]-1-eicosa-5,8,11-triynone IUPAC Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]icosa-5,8,11-triyn-1-one Traditional Name: 1-[4-(2-hydroxyethyl)piperazino]eicosa-5,8,11-triyn-1-one Formula: C26H40N2O2 MolecularWeight: 412.608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CCC#CCC#CCCCC(=O)N1CCN(CC1)CCO

Isomeric SMILES

CCCCCCCCC#CCC#CCC#CCCCC(=O)N1CCN(CC1)CCO

InChI

InChI=1S/C26H40N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(30)28-22-20-27(21-23-28)24-25-29/h29H,2-8,11,14,17-25H2,1H3