(E)-3-[3-[(3-bromanylphenoxy)methyl]-4-methoxy-phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-[(3-bromanylphenoxy)methyl]-4-methoxy-phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[3-[(3-bromophenoxy)methyl]-4-methoxy-phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one CAS Name: (E)-3-[3-[(3-bromophenoxy)methyl]-4-methoxyphenyl]-1-[4-(1-pyrrolyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[3-[(3-bromophenoxy)methyl]-4-methoxyphenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[3-[(3-bromophenoxy)methyl]-4-methoxy-phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Formula: C27H22BrNO3 MolecularWeight: 488.37248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)N3C=CC=C3)COC4=CC(=CC=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)N3C=CC=C3)COC4=CC(=CC=C4)Br

InChI

InChI=1S/C27H22BrNO3/c1-31-27-14-8-20(17-22(27)19-32-25-6-4-5-23(28)18-25)7-13-26(30)21-9-11-24(12-10-21)29-15-2-3-16-29/h2-18H,19H2,1H3/b13-7+