TZK
4-(4-methylphenyl)sulfonylmorpholine
Created: | 2021-01-14 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 31 |
Chiral Atom Count | 0 |
Bond Count | 32 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 4-(4-methylphenyl)sulfonylmorpholine |
Systematic Name (OpenEye OEToolkits) | 4-(4-methylphenyl)sulfonylmorpholine |
Formula | C11 H15 N O3 S |
Molecular Weight | 241.307 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Cc1ccc(cc1)[S](=O)(=O)N2CCOCC2 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)S(=O)(=O)N2CCOCC2 |
Canonical SMILES | CACTVS | 3.385 | Cc1ccc(cc1)[S](=O)(=O)N2CCOCC2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)S(=O)(=O)N2CCOCC2 |
InChI | InChI | 1.03 | InChI=1S/C11H15NO3S/c1-10-2-4-11(5-3-10)16(13,14)12-6-8-15-9-7-12/h2-5H,6-9H2,1H3 |
InChIKey | InChI | 1.03 | NBTTYMBZXDHFCP-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 80645 |
CCDC/CSD | KAVSOP01, KAVSOP, KAVSOP02 |
COD | 4024620 |