A1EKZ
Summary
| Name: | (phenylmethyl) 1-but-3-enoxynaphthalene-2-carboxylate |
| Synonyms: | benzyl 1-(but-3-en-1-yloxy)-2-naphthoate |
| Formula: | C22 H20 O3 |
| Formal charge: | 0 |
| Formula weight: | 332.392 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (phenylmethyl) 1-but-3-enoxynaphthalene-2-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C22H20O3/c1-2-3-15-24-21-19-12-8-7-11-18(19)13-14-20(21)22(23)25-16-17-9-5-4-6-10-17/h2,4-14H,1,3,15-16H2 |
| InChIKey | InChI | 1.06 | AUJGTGJXUCGBFJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C=CCCOc1c(ccc2ccccc12)C(=O)OCc3ccccc3 |
| SMILES | CACTVS | 3.385 | C=CCCOc1c(ccc2ccccc12)C(=O)OCc3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C=CCCOc1c2ccccc2ccc1C(=O)OCc3ccccc3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | C=CCCOc1c2ccccc2ccc1C(=O)OCc3ccccc3 |
