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4-(azepan-1-ylcarbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one

4-(azepan-1-ylcarbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one

Systemtic Name:4-(azepan-1-ylcarbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one
Openeye Name:4-(azepane-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one
CAS Name:4-[1-azepanyl(oxo)methyl]-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one
IUPAC Name:4-(azepane-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one
Traditional Name:4-(azepane-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisocarbostyril
Formula: C25H29FN2O4
MolecularWeight: 440.507163
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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCCCCC3)C4=CC=CC=C4F


Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCCCCC3)C4=CC=CC=C4F


InChI

InChI=1S/C25H29FN2O4/c1-27-23(16-10-6-7-11-19(16)26)22(25(30)28-12-8-4-5-9-13-28)17-14-20(31-2)21(32-3)15-18(17)24(27)29/h6-7,10-11,14-15,22-23H,4-5,8-9,12-13H2,1-3H3


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