LZO
Summary
Name: | 5-(5-(3-hydroxyphenyl)thiophen-2-yl)pentanoic acid |
Formula: | C15 H16 O3 S |
Formal charge: | 0 |
Formula weight: | 276.351 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 5-[5-(3-hydroxyphenyl)thiophen-2-yl]pentanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C15H16O3S/c16-12-5-3-4-11(10-12)14-9-8-13(19-14)6-1-2-7-15(17)18/h3-5,8-10,16H,1-2,6-7H2,(H,17,18) |
InChIKey | InChI | 1.06 | IJYKTKXHUXBNPE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CCCCc1sc(cc1)c2cccc(O)c2 |
SMILES | CACTVS | 3.385 | OC(=O)CCCCc1sc(cc1)c2cccc(O)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)O)c2ccc(s2)CCCCC(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)O)c2ccc(s2)CCCCC(=O)O |