Valerophenone, 5-(4-amino-2-methoxyphenoxy)-, diethyl acetal
HIT212718604
sdf文件结构编辑类似物检索
HIT ID: HIT212718604
Cas No: 15382-91-9
分子式: C22H31NO4
分子量: 373.493
常用名: Valerophenone, 5-(4-amino-2-methoxyphenoxy)-, diethyl acetal
常用名: Valerophenone, 5-(4-amino-2-methoxyphenoxy)-, diethyl acetal
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 4.52649
IUPAC: 4-[(5,5-diethoxy-5-phenylpentyl)oxy]-3-methoxyaniline
IUPAC: 4-[(5,5-diethoxy-5-phenylpentyl)oxy]-3-methoxyaniline
SMILES: CCOC(CCCCOc1ccc(N)cc1OC)(OCC)c1ccccc1
SMILES: CCOC(CCCCOc1ccc(N)cc1OC)(OCC)c1ccccc1
InChI key: PNQOAPPBKSEXKM-UHFFFAOYSA-N
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