(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-(4-morpholinophenyl)prop-2-en-1-one CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-[4-(4-morpholinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-(4-morpholinophenyl)prop-2-en-1-one Formula: C27H35NO3 MolecularWeight: 421.5717

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC(=O)C2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C(=O)C2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C27H35NO3/c1-26(2,3)22-17-19(18-23(25(22)30)27(4,5)6)7-12-24(29)20-8-10-21(11-9-20)28-13-15-31-16-14-28/h7-12,17-18,30H,13-16H2,1-6H3/b12-7+