N2-(3,4-dichlorophenyl)-N4-(2,2-dimethylpropyl)-6-fluoranyl-quinoline-2,4-diamine

Systemtic Name: N2-(3,4-dichlorophenyl)-N4-(2,2-dimethylpropyl)-6-fluoranyl-quinoline-2,4-diamine Openeye Name: N2-(3,4-dichlorophenyl)-N4-(2,2-dimethylpropyl)-6-fluoro-quinoline-2,4-diamine CAS Name: N2-(3,4-dichlorophenyl)-N4-(2,2-dimethylpropyl)-6-fluoroquinoline-2,4-diamine IUPAC Name: 2-N-(3,4-dichlorophenyl)-4-N-(2,2-dimethylpropyl)-6-fluoroquinoline-2,4-diamine Traditional Name: [2-(3,4-dichloroanilino)-6-fluoro-4-quinolyl]-neopentyl-amine Formula: C20H20Cl2FN3 MolecularWeight: 392.297303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=CC(=NC2=C1C=C(C=C2)F)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)CNC1=CC(=NC2=C1C=C(C=C2)F)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H20Cl2FN3/c1-20(2,3)11-24-18-10-19(25-13-5-6-15(21)16(22)9-13)26-17-7-4-12(23)8-14(17)18/h4-10H,11H2,1-3H3,(H2,24,25,26)