3-methyl-5-(4-methylpiperazin-1-yl)-N-octadecyl-2,3,4-tris(oxidanyl)-5-oxidanylidene-pentanamide

Systemtic Name: 3-methyl-5-(4-methylpiperazin-1-yl)-N-octadecyl-2,3,4-tris(oxidanyl)-5-oxidanylidene-pentanamide Openeye Name: 2,3,4-trihydroxy-3-methyl-5-(4-methylpiperazin-1-yl)-N-octadecyl-5-oxo-pentanamide CAS Name: 2,3,4-trihydroxy-3-methyl-5-(4-methyl-1-piperazinyl)-N-octadecyl-5-oxopentanamide IUPAC Name: 2,3,4-trihydroxy-3-methyl-5-(4-methylpiperazin-1-yl)-N-octadecyl-5-oxopentanamide Traditional Name: 2,3,4-trihydroxy-5-keto-3-methyl-5-(4-methylpiperazino)-N-stearyl-valeramide Formula: C29H57N3O5 MolecularWeight: 527.77998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(C(C)(C(C(=O)N1CCN(CC1)C)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(C(C)(C(C(=O)N1CCN(CC1)C)O)O)O

InChI

InChI=1S/C29H57N3O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-30-27(35)25(33)29(2,37)26(34)28(36)32-23-21-31(3)22-24-32/h25-26,33-34,37H,4-24H2,1-3H3,(H,30,35)