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13-[3-(dimethylamino)phenoxy]-8-ethanoyl-12-oxidanyl-tridecanoic acid
13-[3-(dimethylamino)phenoxy]-8-ethanoyl-12-oxidanyl-tridecanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)C(CCCCCCC(=O)O)CCCC(COC1=CC=CC(=C1)N(C)C)O
Isomeric SMILES
CC(=O)C(CCCCCCC(=O)O)CCCC(COC1=CC=CC(=C1)N(C)C)O
InChI
InChI=1S/C23H37NO5/c1-18(25)19(10-6-4-5-7-15-23(27)28)11-8-13-21(26)17-29-22-14-9-12-20(16-22)24(2)3/h9,12,14,16,19,21,26H,4-8,10-11,13,15,17H2,1-3H3,(H,27,28)
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- 13-[3-(dimethylamino)phenoxy]-8-ethanoyl-12-oxidanyl-tridec-5-ynoic acid
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