1-[5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyridin-2-yl]-3-oxidanyl-4-phenyl-butan-2-one

Systemtic Name: 1-[5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyridin-2-yl]-3-oxidanyl-4-phenyl-butan-2-one Openeye Name: 3-hydroxy-1-[5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-2-pyridyl]-4-phenyl-butan-2-one CAS Name: 3-hydroxy-1-[5-[4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-2-pyridinyl]-4-phenyl-2-butanone IUPAC Name: 3-hydroxy-1-[5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyridin-2-yl]-4-phenylbutan-2-one Traditional Name: 3-hydroxy-1-[5-[4-[2-(4-methylpiperazino)ethoxy]phenyl]-2-pyridyl]-4-phenyl-butan-2-one Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCOC2=CC=C(C=C2)C3=CN=C(C=C3)CC(=O)C(CC4=CC=CC=C4)O

Isomeric SMILES

CN1CCN(CC1)CCOC2=CC=C(C=C2)C3=CN=C(C=C3)CC(=O)C(CC4=CC=CC=C4)O

InChI

InChI=1S/C28H33N3O3/c1-30-13-15-31(16-14-30)17-18-34-26-11-8-23(9-12-26)24-7-10-25(29-21-24)20-28(33)27(32)19-22-5-3-2-4-6-22/h2-12,21,27,32H,13-20H2,1H3