1-[2,4-bis[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[2,4-bis[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[2,4-bis[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl]ethanone CAS Name: 1-[2,4-bis[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]phenyl]ethanone IUPAC Name: 1-[2,4-bis[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl]ethanone Traditional Name: 1-[2,4-bis[2-hydroxy-3-(4-methylpiperazino)propoxy]phenyl]ethanone Formula: C24H40N4O5 MolecularWeight: 464.5982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCC(CN2CCN(CC2)C)O)OCC(CN3CCN(CC3)C)O

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCC(CN2CCN(CC2)C)O)OCC(CN3CCN(CC3)C)O

InChI

InChI=1S/C24H40N4O5/c1-19(29)23-5-4-22(32-17-20(30)15-27-10-6-25(2)7-11-27)14-24(23)33-18-21(31)16-28-12-8-26(3)9-13-28/h4-5,14,20-21,30-31H,6-13,15-18H2,1-3H3