77167-87-4
QUINOLINE, 4-(3-(3-ETHYL-4-PIPERIDINYL)PROPYL)-6-METHOXY-, (3S-TRANS)-, (E)-2-BUTENEDIOATE (1:1)
Name
QUINOLINE, 4-(3-(3-ETHYL-4-PIPERIDINYL)PROPYL)-6-METHOXY-, (3S-TRANS)-, (E)-2-BUTENEDIOATE (1:1)
Formula
C20 H28 N2 O . C4 H4 O4
MolWeight
428.526
1Identification
【Name】
QUINOLINE, 4-(3-(3-ETHYL-4-PIPERIDINYL)PROPYL)-6-METHOXY-, (3S-TRANS)-, (E)-2-BUTENEDIOATE (1:1)
【CAS】
【MDL】
MFCD01759807
【English Synonyms】
【Formula】
C20 H28 N2 O . C4 H4 O4
【MolWeight】
428.526
【Inchi】
InChI=1S/C20H28N2O.C4H4O4/c1-3-15-14-21-11-9-16(15)5-4-6-17-10-12-22-20-8-7-18(23-2)13-19(17)20;5-3(6)1-2-4(7)8/h7-8,10,12-13,15-16,21H,3-6,9,11,14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t15-,16-;/m1./s1
【InChIKey】
InChIKey=HXZGWRQXGURYDA-GVNJZHQWSA-N
【SMILES】
CC[C@@H]1CNCC[C@H]1CCCc2ccnc3c2cc(cc3)OC.C(=C/C(=O)O)\C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
QUINOLINE, 4-(3-(3-ETHYL-4-PIPERIDINYL)PROPYL)-6-METHOXY-, (3S-TRANS)-, (E)-2-BUTENEDIOATE (1:1).cml
Quick Release
2-([(CYCLOBUTYLMETHYL)(METHYL)AMINO]METHYL)-N-METHYL-4-NITROANILINE
4-([(CYCLOBUTYLMETHYL)(METHYL)AMINO]METHYL)-N-PROPYLPYRIDIN-2-AMINE
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