1-[3-[2-oxidanyl-3-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]propoxy]phenyl]ethanone

Systemtic Name: 1-[3-[2-oxidanyl-3-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]propoxy]phenyl]ethanone Openeye Name: 1-[3-[2-hydroxy-3-[4-(4-isopropylbenzoyl)piperazin-1-yl]propoxy]phenyl]ethanone CAS Name: 1-[3-[2-hydroxy-3-[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]propoxy]phenyl]ethanone IUPAC Name: 1-[3-[2-hydroxy-3-[4-(4-propan-2-ylbenzoyl)piperazin-1-yl]propoxy]phenyl]ethanone Traditional Name: 1-[3-[3-(4-cumoylpiperazino)-2-hydroxy-propoxy]phenyl]ethanone Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COC3=CC=CC(=C3)C(=O)C)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COC3=CC=CC(=C3)C(=O)C)O

InChI

InChI=1S/C25H32N2O4/c1-18(2)20-7-9-21(10-8-20)25(30)27-13-11-26(12-14-27)16-23(29)17-31-24-6-4-5-22(15-24)19(3)28/h4-10,15,18,23,29H,11-14,16-17H2,1-3H3