OFQ
(2-azanyl-2-adamantyl)methanol
Created: | 2020-03-03 |
Last modified: | 2020-03-11 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 32 |
Chiral Atom Count | 0 |
Bond Count | 34 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2-azanyl-2-adamantyl)methanol |
Systematic Name (OpenEye OEToolkits) | (2-azanyl-2-adamantyl)methanol |
Formula | C11 H19 N O |
Molecular Weight | 181.275 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | NC1(CO)C2CC3CC(C2)CC1C3 |
SMILES | OpenEye OEToolkits | 2.0.7 | C1C2CC3CC1CC(C2)C3(CO)N |
Canonical SMILES | CACTVS | 3.385 | NC1(CO)C2CC3CC(C2)CC1C3 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C1C2CC3CC1CC(C2)C3(CO)N |
InChI | InChI | 1.03 | InChI=1S/C11H19NO/c12-11(6-13)9-2-7-1-8(4-9)5-10(11)3-7/h7-10,13H,1-6,12H2/t7-,8+,9-,10+,11- |
InChIKey | InChI | 1.03 | JNAKWHJSIJOZFK-HQUNYVMJSA-N |