4-[7-chloranyl-2-(2-hydroxyethylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[7-chloranyl-2-(2-hydroxyethylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[7-chloro-2-(2-hydroxyethylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[7-chloro-2-(2-hydroxyethylamino)-4-quinolinyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-chloro-2-(2-hydroxyethylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[7-chloro-2-(2-hydroxyethylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C22H23ClFN5O2 MolecularWeight: 443.901723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)NCCO)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)NCCO)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C22H23ClFN5O2/c23-15-1-6-18-19(13-15)27-21(25-7-12-30)14-20(18)28-8-10-29(11-9-28)22(31)26-17-4-2-16(24)3-5-17/h1-6,13-14,30H,7-12H2,(H,25,27)(H,26,31)