[1-[2-(3-chloranyl-4-fluoranyl-phenyl)quinolin-4-yl]-2-(hydroxymethyl)pyrrolidin-3-ylidene]methanone

Systemtic Name: [1-[2-(3-chloranyl-4-fluoranyl-phenyl)quinolin-4-yl]-2-(hydroxymethyl)pyrrolidin-3-ylidene]methanone Openeye Name: [1-[2-(3-chloro-4-fluoro-phenyl)-4-quinolyl]-2-(hydroxymethyl)pyrrolidin-3-ylidene]methanone CAS Name: [1-[2-(3-chloro-4-fluorophenyl)-4-quinolinyl]-2-(hydroxymethyl)-3-pyrrolidinylidene]methanone IUPAC Name: [1-[2-(3-chloro-4-fluorophenyl)quinolin-4-yl]-2-(hydroxymethyl)pyrrolidin-3-ylidene]methanone Traditional Name: [1-[2-(3-chloro-4-fluoro-phenyl)-4-quinolyl]-2-methylol-pyrrolidin-3-ylidene]methanone Formula: C21H16ClFN2O2 MolecularWeight: 382.815343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1=C=O)CO)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(C(C1=C=O)CO)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H16ClFN2O2/c22-16-9-13(5-6-17(16)23)19-10-20(15-3-1-2-4-18(15)24-19)25-8-7-14(11-26)21(25)12-27/h1-6,9-10,21,27H,7-8,12H2