EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H22BrNO2 |
| Net Charge | 0 |
| Average Mass | 412.327 |
| Monoisotopic Mass | 411.08339 |
| SMILES | [H]C([H])=C([H])C([H])([H])N(C([H])([H])[H])C([H])([H])/C([H])=C(\[H])C([H])([H])Oc1c([H])c([H])c2c(-c3c([H])c([H])c(Br)c([H])c3[H])c([H])oc2c1[H] |
| InChI | InChI=1S/C22H22BrNO2/c1-3-12-24(2)13-4-5-14-25-19-10-11-20-21(16-26-22(20)15-19)17-6-8-18(23)9-7-17/h3-11,15-16H,1,12-14H2,2H3/b5-4+ |
| InChIKey | KCNKJCHARANTIP-SNAWJCMRSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2E)-4-{[3-(4-bromophenyl)-1-benzofuran-6-yl]oxy}-N-methyl-N-prop-2-en-1-ylbut-2-en-1-amine (CHEBI:47640) is a 1-benzofurans (CHEBI:38830) |
| (2E)-4-{[3-(4-bromophenyl)-1-benzofuran-6-yl]oxy}-N-methyl-N-prop-2-en-1-ylbut-2-en-1-amine (CHEBI:47640) is a organobromine compound (CHEBI:37141) |
| (2E)-4-{[3-(4-bromophenyl)-1-benzofuran-6-yl]oxy}-N-methyl-N-prop-2-en-1-ylbut-2-en-1-amine (CHEBI:47640) is a tertiary amine (CHEBI:32876) |
| Synonyms | Source |
|---|---|
| (2E)-4-{[3-(4-bromophenyl)-1-benzofuran-6-yl]oxy}-N-methyl-N-prop-2-en-1-ylbut-2-en-1-amine | PDBeChem |
| ALLYL-{4-[3-(4-BROMO-PHENYL)-BENZOFURAN-6-YLOXY]-BUT-2-ENYL}-METHYL-AMINE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| R17 | PDBeChem |