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Predict NMR spectrum
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| InChI: |
1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17-,18+/m0/s1 |
| InChIKey: |
IYGYMKDQCDOMRE-ZWKOTPCHSA-N |
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| H donor: |
0 |
| H acceptor: |
7 |
| Rotatable bond: |
1 |
| Stereocenter: |
2 |
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| cLogP: |
2.908 |
| cLogS: |
-4.053 |
| Polar surface: |
66.46 |
| NEW: 3D model: |
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