(2-oxidanylidene-2-piperidin-4-yloxy-ethyl) 2-[(7-chloranylquinolin-4-yl)-prop-2-ynyl-amino]benzoate

Systemtic Name: (2-oxidanylidene-2-piperidin-4-yloxy-ethyl) 2-[(7-chloranylquinolin-4-yl)-prop-2-ynyl-amino]benzoate Openeye Name: [2-oxo-2-(4-piperidyloxy)ethyl] 2-[(7-chloro-4-quinolyl)-prop-2-ynyl-amino]benzoate CAS Name: 2-[(7-chloro-4-quinolinyl)-prop-2-ynylamino]benzoic acid [2-oxo-2-(4-piperidinyloxy)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-4-yloxyethyl) 2-[(7-chloroquinolin-4-yl)-prop-2-ynylamino]benzoate Traditional Name: 2-[(7-chloro-4-quinolyl)-propargyl-amino]benzoic acid [2-keto-2-(4-piperidyloxy)ethyl] ester Formula: C26H24ClN3O4 MolecularWeight: 477.93946

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1=C2C=CC(=CC2=NC=C1)Cl)C3=CC=CC=C3C(=O)OCC(=O)OC4CCNCC4

Isomeric SMILES

C#CCN(C1=C2C=CC(=CC2=NC=C1)Cl)C3=CC=CC=C3C(=O)OCC(=O)OC4CCNCC4

InChI

InChI=1S/C26H24ClN3O4/c1-2-15-30(24-11-14-29-22-16-18(27)7-8-20(22)24)23-6-4-3-5-21(23)26(32)33-17-25(31)34-19-9-12-28-13-10-19/h1,3-8,11,14,16,19,28H,9-10,12-13,15,17H2