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3-(2-ethylphenyl)-7-(3-oxidanylpiperidin-1-yl)-2H-isoquinolin-1-one

3-(2-ethylphenyl)-7-(3-oxidanylpiperidin-1-yl)-2H-isoquinolin-1-one

Systemtic Name:3-(2-ethylphenyl)-7-(3-oxidanylpiperidin-1-yl)-2H-isoquinolin-1-one
Openeye Name:3-(2-ethylphenyl)-7-(3-hydroxy-1-piperidyl)-2H-isoquinolin-1-one
CAS Name:3-(2-ethylphenyl)-7-(3-hydroxy-1-piperidinyl)-2H-isoquinolin-1-one
IUPAC Name:3-(2-ethylphenyl)-7-(3-hydroxypiperidin-1-yl)-2H-isoquinolin-1-one
Traditional Name:3-(2-ethylphenyl)-7-(3-hydroxypiperidino)isocarbostyril
Formula: C22H24N2O2
MolecularWeight: 348.43816
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C2=CC3=C(C=C(C=C3)N4CCCC(C4)O)C(=O)N2


Isomeric SMILES

CCC1=CC=CC=C1C2=CC3=C(C=C(C=C3)N4CCCC(C4)O)C(=O)N2


InChI

InChI=1S/C22H24N2O2/c1-2-15-6-3-4-8-19(15)21-12-16-9-10-17(13-20(16)22(26)23-21)24-11-5-7-18(25)14-24/h3-4,6,8-10,12-13,18,25H,2,5,7,11,14H2,1H3,(H,23,26)


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