N-(3-fluoranylpropyl)-1-(4-iodophenyl)-N-methyl-isoquinoline-3-carboxamide

Systemtic Name: N-(3-fluoranylpropyl)-1-(4-iodophenyl)-N-methyl-isoquinoline-3-carboxamide Openeye Name: N-(3-fluoropropyl)-1-(4-iodophenyl)-N-methyl-isoquinoline-3-carboxamide CAS Name: N-(3-fluoropropyl)-1-(4-iodophenyl)-N-methyl-3-isoquinolinecarboxamide IUPAC Name: N-(3-fluoropropyl)-1-(4-iodophenyl)-N-methylisoquinoline-3-carboxamide Traditional Name: N-(3-fluoropropyl)-1-(4-iodophenyl)-N-methyl-isoquinoline-3-carboxamide Formula: C20H18FIN2O MolecularWeight: 448.272593

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCF)C(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=C(C=C3)I

Isomeric SMILES

CN(CCCF)C(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=C(C=C3)I

InChI

InChI=1S/C20H18FIN2O/c1-24(12-4-11-21)20(25)18-13-15-5-2-3-6-17(15)19(23-18)14-7-9-16(22)10-8-14/h2-3,5-10,13H,4,11-12H2,1H3