4-[3-fluoranyl-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxylic acid

Systemtic Name: 4-[3-fluoranyl-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxylic acid Openeye Name: 4-[3-fluoro-6-methoxy-7-[3-(1-piperidyl)propoxy]-4-quinolyl]piperazine-1-carboxylic acid CAS Name: 4-[3-fluoro-6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinolinyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[3-fluoro-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxylic acid Traditional Name: 4-[3-fluoro-6-methoxy-7-(3-piperidinopropoxy)-4-quinolyl]piperazine-1-carboxylic acid Formula: C23H31FN4O4 MolecularWeight: 446.515043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)F)N3CCN(CC3)C(=O)O)OCCCN4CCCCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)F)N3CCN(CC3)C(=O)O)OCCCN4CCCCC4

InChI

InChI=1S/C23H31FN4O4/c1-31-20-14-17-19(15-21(20)32-13-5-8-26-6-3-2-4-7-26)25-16-18(24)22(17)27-9-11-28(12-10-27)23(29)30/h14-16H,2-13H2,1H3,(H,29,30)