303998-56-3 (5-氯-1-[(3,4-二氯苯基)甲基]-1H-吲哚-2,3-二酮 3-[o-(2-氯乙酰基)肟],1H-Indole-2,3-dione, 5-chloro-1-[(3,4-dichlorophenyl)methyl]-, 3-[O-(2-chloroacetyl)oxime])

CAS号:
303998-56-3
中文名称:
5-氯-1-[(3,4-二氯苯基)甲基]-1H-吲哚-2,3-二酮 3-[o-(2-氯乙酰基)肟]
英文名称:
1H-Indole-2,3-dione, 5-chloro-1-[(3,4-dichlorophenyl)methyl]-, 3-[O-(2-chloroacetyl)oxime]
分子式:
C17H10N2O3Cl4
分子量:
432.0849

5-氯-1-[(3,4-二氯苯基)甲基]-1H-吲哚-2,3-二酮 3-[o-(2-氯乙酰基)肟](303998-56-3)名称与标识符

名称

中文别名:
5-氯-1-[(3,4-二氯苯基)甲基]-1H-吲哚-2,3-二酮 3-[o-(2-氯乙酰基)肟];
英文别名:
1H-Indole-2,3-dione, 5-chloro-1-[(3,4-dichlorophenyl)methyl]-, 3-[O-(2-chloroacetyl)oxime];[[5-chloro-1-[(3,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 2-chloroacetate;5-chloro-1-[(3,4-dichlorophenyl)methyl]-1H-Indole-2,3-dione 3-[O-(2-chloroacetyl)oxime];5-Chlor-1-(3,4-dichlorbenzyl)-1H-indol-2,3-dion-3-[O-(2-chloracetyl)oxim];5-chloro-3-[(2-chloroacetoxy)imino]-1-(3,4-dichlorobenzyl)-1,3-dihydro-2H-indol-2-one;

标识符

InChIKey:
RVKASSIILVXNFJ-JWGURIENSA-N
Inchi:
InChI=1S/C17H10Cl4N2O3/c18-7-15(24)26-22-16-11-6-10(19)2-4-14(11)23(17(16)25)8-9-1-3-12(20)13(21)5-9/h1-6H,7-8H2/b22-16-
SMILES:
C1=CC(=C(C=C1CN2C3=C(C=C(C=C3)Cl)/C(=N/OC(=O)CCl)/C2=O)Cl)Cl

5-氯-1-[(3,4-二氯苯基)甲基]-1H-吲哚-2,3-二酮 3-[o-(2-氯乙酰基)肟](303998-56-3)物化性质

实验特性

  • PSA : 58.97

计算特性

  • 精确分子量 : 429.9448
  • 氢键供体数量 : 0
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 5
  • 重原子数量 : 26