904815-72-1
TERT-BUTYL 4-[(2Z)-2-(HYDROXYIMINO)-2-(4-METHOXYPHENYL)ETHYL]PIPERAZINE-1-CARBOXYLATE
NameTERT-BUTYL 4-[(2Z)-2-(HYDROXYIMINO)-2-(4-METHOXYPHENYL)ETHYL]PIPERAZINE-1-CARBOXYLATE
1Identification
【Name】
TERT-BUTYL 4-[(2Z)-2-(HYDROXYIMINO)-2-(4-METHOXYPHENYL)ETHYL]PIPERAZINE-1-CARBOXYLATE
【CAS】
【MDL】
MFCD06245551
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C18 H27 N3 O4
【pro_molWeight】
349.428
【Inchi】
InChI=1S/C18H27N3O4/c1-18(2,3)25-17(22)21-11-9-20(10-12-21)13-16(19-23)14-5-7-15(24-4)8-6-14/h5-8,23H,9-13H2,1-4H3/b19-16+
【InChIKey】
InChIKey=WJIZHULBSSWCEO-KNTRCKAVSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCN(CC1)C/C(=N\O)/c2ccc(cc2)OC
【MOL File】
TERT-BUTYL 4-[(2Z)-2….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
TERT-BUTYL 4-[(2Z)-2-(HYDROXYIMINO)-2-(4-METHOXYPHENYL)ETHYL]PIPERAZINE-1-CARBOXYLATE.cml