methyl 4-[2-[2-(4-phenylpiperazin-1-yl)quinolin-8-yl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[2-(4-phenylpiperazin-1-yl)quinolin-8-yl]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[[2-(4-phenylpiperazin-1-yl)-8-quinolyl]oxy]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[[2-(4-phenyl-1-piperazinyl)-8-quinolinyl]oxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-(4-phenylpiperazin-1-yl)quinolin-8-yl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[[2-(4-phenylpiperazino)-8-quinolyl]oxy]acetyl]amino]benzoic acid methyl ester Formula: C29H28N4O4 MolecularWeight: 496.55702

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O4/c1-36-29(35)22-10-13-23(14-11-22)30-27(34)20-37-25-9-5-6-21-12-15-26(31-28(21)25)33-18-16-32(17-19-33)24-7-3-2-4-8-24/h2-15H,16-20H2,1H3,(H,30,34)