1-[4-[4-[4-ethoxy-2-(4-fluorophenyl)quinolin-6-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[4-ethoxy-2-(4-fluorophenyl)quinolin-6-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[4-ethoxy-2-(4-fluorophenyl)quinoline-6-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[4-ethoxy-2-(4-fluorophenyl)-6-quinolinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[4-ethoxy-2-(4-fluorophenyl)quinoline-6-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[4-ethoxy-2-(4-fluorophenyl)quinoline-6-carbonyl]piperazino]phenyl]ethanone Formula: C30H28FN3O3 MolecularWeight: 497.560023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C5=CC=C(C=C5)F

Isomeric SMILES

CCOC1=CC(=NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C5=CC=C(C=C5)F

InChI

InChI=1S/C30H28FN3O3/c1-3-37-29-19-28(22-4-9-24(31)10-5-22)32-27-13-8-23(18-26(27)29)30(36)34-16-14-33(15-17-34)25-11-6-21(7-12-25)20(2)35/h4-13,18-19H,3,14-17H2,1-2H3