(E)-1-(4-aminophenyl)-3-[3,5-bis(2-methylbutan-2-yl)-2-oxidanyl-6-propoxy-phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-aminophenyl)-3-[3,5-bis(2-methylbutan-2-yl)-2-oxidanyl-6-propoxy-phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-aminophenyl)-3-[3,5-bis(1,1-dimethylpropyl)-2-hydroxy-6-propoxy-phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-aminophenyl)-3-[2-hydroxy-3,5-bis(2-methylbutan-2-yl)-6-propoxyphenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-aminophenyl)-3-[2-hydroxy-3,5-bis(2-methylbutan-2-yl)-6-propoxyphenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-aminophenyl)-3-(3,5-ditert-amyl-2-hydroxy-6-propoxy-phenyl)prop-2-en-1-one Formula: C28H39NO3 MolecularWeight: 437.61416

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1C=CC(=O)C2=CC=C(C=C2)N)O)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1/C=C/C(=O)C2=CC=C(C=C2)N)O)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C28H39NO3/c1-8-17-32-26-21(15-16-24(30)19-11-13-20(29)14-12-19)25(31)22(27(4,5)9-2)18-23(26)28(6,7)10-3/h11-16,18,31H,8-10,17,29H2,1-7H3/b16-15+