Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LB5JA0
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| Ligand Name |
2-(Nitrooxy)ethyl 2-(4-{2-[(3,5-Dimethylphenyl)amino]-2-Oxoethyl}phenoxy)-2-Methylpropanoate
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| Synonyms |
2-(Nitrooxy)ethyl 2-(4-{2-[(3,5-Dimethylphenyl)amino]-2-Oxoethyl}phenoxy)-2-Methylpropanoate; SCHEMBL16861099; Q27455800; 5JN
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| Structure |
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Download2D MOL |
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| Formula |
C22H26N2O7
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| Canonical SMILES |
CC1=CC(=CC(=C1)NC(=O)CC2=CC=C(C=C2)OC(C)(C)C(=O)OCCO[N+](=O)[O-])C
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| InChI |
1S/C22H26N2O7/c1-15-11-16(2)13-18(12-15)23-20(25)14-17-5-7-19(8-6-17)31-22(3,4)21(26)29-9-10-30-24(27)28/h5-8,11-13H,9-10,14H2,1-4H3,(H,23,25)
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| InChIKey |
TVDZEGBJVSYGIU-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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