5083-09-0
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-5,6,7-TRIMETHOXY-1-[(4-METHOXYPHENYL)METHYL]
Name
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-5,6,7-TRIMETHOXY-1-[(4-METHOXYPHENYL)METHYL]
Formula
C20 H25 N O4
MolWeight
343.421
1Identification
【Name】
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-5,6,7-TRIMETHOXY-1-[(4-METHOXYPHENYL)METHYL]
【CAS】
【MDL】
MFCD20260125
【English Synonyms】
【Formula】
C20 H25 N O4
【MolWeight】
343.421
【Inchi】
InChI=1S/C20H25NO4/c1-22-14-7-5-13(6-8-14)11-17-16-12-18(23-2)20(25-4)19(24-3)15(16)9-10-21-17/h5-8,12,17,21H,9-11H2,1-4H3
【InChIKey】
InChIKey=CMQSBRRTRZPLHE-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1)CC2c3cc(c(c(c3CCN2)OC)OC)OC
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F