N-(2-chloranyl-4-fluoranyl-phenyl)-1-(diethylamino)isoquinoline-4-carboxamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-1-(diethylamino)isoquinoline-4-carboxamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-1-(diethylamino)isoquinoline-4-carboxamide CAS Name: N-(2-chloro-4-fluorophenyl)-1-(diethylamino)-4-isoquinolinecarboxamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-1-(diethylamino)isoquinoline-4-carboxamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-1-(diethylamino)isoquinoline-4-carboxamide Formula: C20H19ClFN3O MolecularWeight: 371.835763

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC=C(C2=CC=CC=C21)C(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCN(CC)C1=NC=C(C2=CC=CC=C21)C(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H19ClFN3O/c1-3-25(4-2)19-15-8-6-5-7-14(15)16(12-23-19)20(26)24-18-10-9-13(22)11-17(18)21/h5-12H,3-4H2,1-2H3,(H,24,26)