Cyanine7 azide
HIT219251145
sdf文件结构编辑类似物检索
HIT ID: HIT219251145
Cas No:
分子式: C37H47ClN6O
分子量: 627.27
常用名: Cyanine7 azide
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(1E,3E,5E)-7-[(2E)-1-{5-[(3-azidopropyl)carbamoyl]pentyl}-3,3-dimethyl-2,3-dihydro-1H-indol-2-ylidene]hepta-1,3,5-trien-1-yl]-1,3,3-trimethyl-3H-indol-1-ium chloride
IUPAC: 2-[(1E,3E,5E)-7-[(2E)-1-{5-[(3-azidopropyl)carbamoyl]pentyl}-3,3-dimethyl-2,3-dihydro-1H-indol-2-ylidene]hepta-1,3,5-trien-1-yl]-1,3,3-trimethyl-3H-indol-1-ium chloride
SMILES: [Cl-].C[N+]1=C(\C=C\C=C\C=C\C=C2\N(CCCCCC(=O)NCCCN=[N+]=[N-])c3ccccc3C2(C)C)C(C)(C)c2ccccc12
SMILES: [Cl-].C[N+]1=C(\C=C\C=C\C=C\C=C2\N(CCCCCC(=O)NCCCN=[N+]=[N-])c3ccccc3C2(C)C)C(C)(C)c2ccccc12
InChI key: OXKCJKDNWHZOKO-UHFFFAOYSA-N
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