N-[3-(3-fluoranylphenoxy)-2-(isoquinolin-5-ylcarbamoylamino)propyl]carbamate

Systemtic Name: N-[3-(3-fluoranylphenoxy)-2-(isoquinolin-5-ylcarbamoylamino)propyl]carbamate Openeye Name: N-[3-(3-fluorophenoxy)-2-(5-isoquinolylcarbamoylamino)propyl]carbamate CAS Name: N-[3-(3-fluorophenoxy)-2-[[(5-isoquinolinylamino)-oxomethyl]amino]propyl]carbamate IUPAC Name: N-[3-(3-fluorophenoxy)-2-(isoquinolin-5-ylcarbamoylamino)propyl]carbamate Traditional Name: N-[3-(3-fluorophenoxy)-2-(5-isoquinolylcarbamoylamino)propyl]carbamate Formula: C20H18FN4O4- MolecularWeight: 397.379723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)OCC(CNC(=O)[O-])NC(=O)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

C1=CC(=CC(=C1)F)OCC(CNC(=O)[O-])NC(=O)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C20H19FN4O4/c21-14-4-2-5-16(9-14)29-12-15(11-23-20(27)28)24-19(26)25-18-6-1-3-13-10-22-8-7-17(13)18/h1-10,15,23H,11-12H2,(H,27,28)(H2,24,25,26)/p-1