(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(4-pyridin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(4-pyridin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-[4-(2-pyridyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-[4-(2-pyridinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(4-pyridin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-[4-(2-pyridyl)piperazino]prop-2-en-1-one Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C26H35N3O2/c1-25(2,3)20-17-19(18-21(24(20)31)26(4,5)6)10-11-23(30)29-15-13-28(14-16-29)22-9-7-8-12-27-22/h7-12,17-18,31H,13-16H2,1-6H3/b11-10+