N-ethyl-3-[7-[2-(4-fluoranylpiperidin-1-yl)ethoxy]-1-oxidanylidene-isoquinolin-2-yl]-4-methyl-benzamide

Systemtic Name: N-ethyl-3-[7-[2-(4-fluoranylpiperidin-1-yl)ethoxy]-1-oxidanylidene-isoquinolin-2-yl]-4-methyl-benzamide Openeye Name: N-ethyl-3-[7-[2-(4-fluoro-1-piperidyl)ethoxy]-1-oxo-2-isoquinolyl]-4-methyl-benzamide CAS Name: N-ethyl-3-[7-[2-(4-fluoro-1-piperidinyl)ethoxy]-1-oxo-2-isoquinolinyl]-4-methylbenzamide IUPAC Name: N-ethyl-3-[7-[2-(4-fluoropiperidin-1-yl)ethoxy]-1-oxoisoquinolin-2-yl]-4-methylbenzamide Traditional Name: N-ethyl-3-[7-[2-(4-fluoropiperidino)ethoxy]-1-keto-2-isoquinolyl]-4-methyl-benzamide Formula: C26H30FN3O3 MolecularWeight: 451.533103

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C(C=C1)C)N2C=CC3=C(C2=O)C=C(C=C3)OCCN4CCC(CC4)F

Isomeric SMILES

CCNC(=O)C1=CC(=C(C=C1)C)N2C=CC3=C(C2=O)C=C(C=C3)OCCN4CCC(CC4)F

InChI

InChI=1S/C26H30FN3O3/c1-3-28-25(31)20-5-4-18(2)24(16-20)30-13-8-19-6-7-22(17-23(19)26(30)32)33-15-14-29-11-9-21(27)10-12-29/h4-8,13,16-17,21H,3,9-12,14-15H2,1-2H3,(H,28,31)