XE2
Summary
Name: | (6P)-6-(furan-2-yl)-2-hydroxynaphthalene-1-carbaldehyde |
Formula: | C15 H10 O3 |
Formal charge: | 0 |
Formula weight: | 238.238 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (6P)-6-(furan-2-yl)-2-hydroxynaphthalene-1-carbaldehyde |
OpenEye OEToolkits | 2.0.7 | 6-(furan-2-yl)-2-oxidanyl-naphthalene-1-carbaldehyde |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Oc1ccc2cc(ccc2c1C=O)c1ccco1 |
InChI | InChI | 1.06 | InChI=1S/C15H10O3/c16-9-13-12-5-3-11(15-2-1-7-18-15)8-10(12)4-6-14(13)17/h1-9,17H |
InChIKey | InChI | 1.06 | PAWZXRDGPTWKSP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc2cc(ccc2c1C=O)c3occc3 |
SMILES | CACTVS | 3.385 | Oc1ccc2cc(ccc2c1C=O)c3occc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)c2ccc3c(c2)ccc(c3C=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)c2ccc3c(c2)ccc(c3C=O)O |