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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(C(=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)N)OC(C)C)C(C)(C)CC)O

Isomeric SMILES

CCC(C)(C)C1=C(C(=C(C(=C1)/C=C/C(=O)C2=CC=C(C=C2)N)OC(C)C)C(C)(C)CC)O

InChI

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