(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1-(4-tert-butylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1-(4-tert-butylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1-(4-tert-butylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1-(4-tert-butylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1-(4-tert-butylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1-(4-tert-butylphenyl)prop-2-en-1-one Formula: C22H25BrO3 MolecularWeight: 417.3361

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)C2=CC=C(C=C2)C(C)(C)C)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)C(C)(C)C)Br)OC

InChI

InChI=1S/C22H25BrO3/c1-6-26-20-14-15(13-18(23)21(20)25-5)7-12-19(24)16-8-10-17(11-9-16)22(2,3)4/h7-14H,6H2,1-5H3/b12-7+