N-(4-cyanophenyl)-2-[[1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidin-4-yl]amino]ethanamide

Systemtic Name: N-(4-cyanophenyl)-2-[[1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidin-4-yl]amino]ethanamide Openeye Name: N-(4-cyanophenyl)-2-[[1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]-4-piperidyl]amino]acetamide CAS Name: N-(4-cyanophenyl)-2-[[1-[2-hydroxy-2-(6-methoxy-4-quinolinyl)ethyl]-4-piperidinyl]amino]acetamide IUPAC Name: N-(4-cyanophenyl)-2-[[1-[2-hydroxy-2-(6-methoxyquinolin-4-yl)ethyl]piperidin-4-yl]amino]acetamide Traditional Name: N-(4-cyanophenyl)-2-[[1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]-4-piperidyl]amino]acetamide Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(CC3)NCC(=O)NC4=CC=C(C=C4)C#N)O

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(CC3)NCC(=O)NC4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C26H29N5O3/c1-34-21-6-7-24-23(14-21)22(8-11-28-24)25(32)17-31-12-9-19(10-13-31)29-16-26(33)30-20-4-2-18(15-27)3-5-20/h2-8,11,14,19,25,29,32H,9-10,12-13,16-17H2,1H3,(H,30,33)