N-[(4-chlorophenyl)methyl]-1-(2-diethylaminoethyl)-8-fluoranyl-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(2-diethylaminoethyl)-8-fluoranyl-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-(2-diethylaminoethyl)-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-(2-diethylaminoethyl)-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(2-diethylaminoethyl)-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-(2-diethylaminoethyl)-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-keto-quinoline-3-carboxamide Formula: C26H27ClFN3O3 MolecularWeight: 483.962283

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C=C(C(=O)C2=C1C(=CC(=C2)C#CCO)F)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(CC)CCN1C=C(C(=O)C2=C1C(=CC(=C2)C#CCO)F)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H27ClFN3O3/c1-3-30(4-2)11-12-31-17-22(26(34)29-16-18-7-9-20(27)10-8-18)25(33)21-14-19(6-5-13-32)15-23(28)24(21)31/h7-10,14-15,17,32H,3-4,11-13,16H2,1-2H3,(H,29,34)