3VJ
3-[2-(3,5-dichlorophenyl)-2-methylpropanoyl]-N-(2-{[(2Z)-2-iminoethyl]amino}-2-oxoethyl)-4-methoxybenzamide
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as a non-polymer is covalently linked to polymer or other heterogen groups 1 entries
Chemical Component Summary | |
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Name | 3-[2-(3,5-dichlorophenyl)-2-methylpropanoyl]-N-(2-{[(2Z)-2-iminoethyl]amino}-2-oxoethyl)-4-methoxybenzamide |
Identifiers | N-[2-(2-azanylideneethylamino)-2-oxidanylidene-ethyl]-3-[2-[3,5-bis(chloranyl)phenyl]-2-methyl-propanoyl]-4-methoxy-benzamide |
Formula | C22 H23 Cl2 N3 O4 |
Molecular Weight | 464.342 |
Type | NON-POLYMER |
Isomeric SMILES | [H]/N=C\CNC(=O)CNC(=O)c1ccc(c(c1)C(=O)C(C)(C)c2cc(cc(c2)Cl)Cl)OC |
InChI | InChI=1S/C22H23Cl2N3O4/c1-22(2,14-9-15(23)11-16(24)10-14)20(29)17-8-13(4-5-18(17)31-3)21(30)27-12-19(28)26-7-6-25/h4-6,8-11,25H,7,12H2,1-3H3,(H,26,28)(H,27,30)/b25-6- |
InChIKey | BXGGHAHXZXWBGP-HGBQSQDTSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 54 |
Chiral Atom Count | 0 |
Bond Count | 55 |
Aromatic Bond Count | 12 |