71Y
~{N}-[(1~{S},2~{S})-7-chloranyl-2-oxidanyl-1,2,3,4-tetrahydronaphthalen-1-yl]-4-ethanoyl-3-ethyl-5-methyl-1~{H}-pyrrole -2-carboxamide
Find entries where: 71Y
is present as a standalone ligand in 1 entries
as a non-polymer is covalently linked to polymer or other heterogen groups 1 entries
Chemical Component Summary | |
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Name | ~{N}-[(1~{S},2~{S})-7-chloranyl-2-oxidanyl-1,2,3,4-tetrahydronaphthalen-1-yl]-4-ethanoyl-3-ethyl-5-methyl-1~{H}-pyrrole -2-carboxamide |
Synonyms | I-p300 |
Identifiers | ~{N}-[(1~{S},2~{S})-7-chloranyl-2-oxidanyl-1,2,3,4-tetrahydronaphthalen-1-yl]-4-ethanoyl-3-ethyl-5-methyl-1~{H}-pyrrole-2-carboxamide |
Formula | C20 H23 Cl N2 O3 |
Molecular Weight | 374.861 |
Type | NON-POLYMER |
Isomeric SMILES | CCc1c(c([nH]c1C(=O)N[C@H]2c3cc(ccc3CC[C@@H]2O)Cl)C)C(=O)C |
InChI | InChI=1S/C20H23ClN2O3/c1-4-14-17(11(3)24)10(2)22-19(14)20(26)23-18-15-9-13(21)7-5-12(15)6-8-16(18)25/h5,7,9,16,18,22,25H,4,6,8H2,1-3H3,(H,23,26)/t16-,18-/m0/s1 |
InChIKey | KVJAGYRUNZONPJ-WMZOPIPTSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 49 |
Chiral Atom Count | 2 |
Bond Count | 51 |
Aromatic Bond Count | 11 |
Related Resource References
Resource Name | Reference |
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PubChem | 129318943 |