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6-[1,4-diazepan-1-yl-(4-methoxyphenyl)methyl]isoquinoline

6-[1,4-diazepan-1-yl-(4-methoxyphenyl)methyl]isoquinoline

Systemtic Name:6-[1,4-diazepan-1-yl-(4-methoxyphenyl)methyl]isoquinoline
Openeye Name:6-[1,4-diazepan-1-yl-(4-methoxyphenyl)methyl]isoquinoline
CAS Name:6-[1,4-diazepan-1-yl-(4-methoxyphenyl)methyl]isoquinoline
IUPAC Name:6-[1,4-diazepan-1-yl-(4-methoxyphenyl)methyl]isoquinoline
Traditional Name:6-[1,4-diazepan-1-yl-(4-methoxyphenyl)methyl]isoquinoline
Formula: C22H25N3O
MolecularWeight: 347.4534
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCCNCC4


Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCCNCC4


InChI

InChI=1S/C22H25N3O/c1-26-21-7-5-17(6-8-21)22(25-13-2-10-23-12-14-25)19-3-4-20-16-24-11-9-18(20)15-19/h3-9,11,15-16,22-23H,2,10,12-14H2,1H3


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