Q5Q
Summary
Name: | 3,6-dibromo-1-(hydroxymethyl)carbazole |
Synonyms: | 3,4-bis(bromanyl)-6-methyl-9~{H}-carbazol-1-ol |
Formula: | C13 H9 Br2 N O |
Formal charge: | 0 |
Formula weight: | 355.025 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 3,4-bis(bromanyl)-6-methyl-9~{H}-carbazol-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C13H9Br2NO/c1-6-2-3-9-7(4-6)11-12(15)8(14)5-10(17)13(11)16-9/h2-5,16-17H,1H3 |
InChIKey | InChI | 1.03 | LFOHIKGNXVHWSB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc2[nH]c3c(O)cc(Br)c(Br)c3c2c1 |
SMILES | CACTVS | 3.385 | Cc1ccc2[nH]c3c(O)cc(Br)c(Br)c3c2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc2c(c1)c3c([nH]2)c(cc(c3Br)Br)O |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc2c(c1)c3c([nH]2)c(cc(c3Br)Br)O |