| Properties | Image |
| MNX_ID | MNXM171432 |
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| reference | chebi:114822 |
| formula | C17H20N2O2 |
| global charge | 0 |
| mol weight | 284.359 |
| InChIKey | RUNWFOIXOHBRTB-BZUAXINKSA-N |
| InChI | InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16-/m1/s1 |
| SMILES | N#C[C@@H]1[C@@H](C2=CC=CC=C2)[C@@H](CO)N1C(=O)C1CCCC1 |
MNX internals
| InChI (mnx) | InChI=1/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16-/m1/s1 |
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| SMILES (mnx) | [CH:1]1=[CH:2][CH:6]=[C:12]([C@@H:16]2[C@@H:14]([C:10]#[N:18])[N:19]([C:17]([CH:13]3[CH2:8][CH2:4][CH2:5][CH2:9]3)=[O:21])[C@@H:15]2[CH2:11][OH:20])[CH:7]=[CH:3]1 |
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