Pentamethylene bis[1-(3,4-dimethoxybenzyl)-3,4-dihydro-6,7-dimethoxy-1H-isoquinoline-2-propionate],diformate

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Catalog Number
ACM94113287
Product Name
Pentamethylene bis[1-(3,4-dimethoxybenzyl)-3,4-dihydro-6,7-dimethoxy-1H-isoquinoline-2-propionate],diformate
CAS
94113-28-7
Category
Heterocyclic Organic Compound
Synonyms
EINECS 302-559-9, 94113-28-7, Pentamethylene bis(1-(3,4-dimethoxybenzyl)-3,4-dihydro-6,7-dimethoxy-1H-isoquinoline-2-propionate), diformate
IUPAC Name
5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate; formic acid
Molecular Weight
991.126700 [g/mol]
Molecular Formula
C51H66N2O12.2CH2O2
Canonical SMILES
COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2CCC(=O)OCCCCCOC(=O)CCN4CCC5=CC(=C(C=C5C4CC6=CC(=C(C=C6)OC)OC)OC)OC)OC)OC)OC.C(=O)O.C(=O)O
InChI Key
CTENIIJYPJHVQX-UHFFFAOYSA-N
EC Number
302-559-9
Exact Mass
990.47300
H-Bond Acceptor
18
H-Bond Donor
2
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