4-氧杂-8-氮杂三环[5.1.0.03,5]辛烷(9CI)

CAS号
82956-02-3
CCD编号
CCD00253635
分子式
C19 H17 N3 O2 . 2 C H4 O3 S
分子量
511.573

基本信息

产品名称: 4-氧杂-8-氮杂三环[5.1.0.03,5]辛烷(9CI)
CAS: 82956-02-3
中文同义词: 4-氧杂-8-氮杂三环[5.1.0.03,5]辛烷(9CI)
英文同义词: 6-AMIDINO-2-NAPHTHYL-4-AMINOMETHYLBENZOATE DIMETHANESULFONATE
MDL号: MFCD01766304
氢键受体数量: 5
氢键供体数量: 3
Smile: CS(=O)(=O)O.CS(=O)(=O)O.c1cc(ccc1CN)C(=O)Oc2ccc3cc(ccc3c2)C(=N)N
InChi: InChI=1S/C19H17N3O2.2CH4O3S/c20-11-12-1-3-13(4-2-12)19(23)24-17-8-7-14-9-16(18(21)22)6-5-15(14)10-17;2*1-5(2,3)4/h1-10H,11,20H2,(H3,21,22);2*1H3,(H,2,3,4)
InChiKey: InChIKey=IKHXKNHEMGSPQB-UHFFFAOYSA-N

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