ethyl 1-(7-chloranylquinolin-4-yl)-5-[(2-morpholin-4-ylethylamino)methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(7-chloranylquinolin-4-yl)-5-[(2-morpholin-4-ylethylamino)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(7-chloro-4-quinolyl)-5-[(2-morpholinoethylamino)methyl]pyrazole-4-carboxylate CAS Name: 1-(7-chloro-4-quinolinyl)-5-[[2-(4-morpholinyl)ethylamino]methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(7-chloroquinolin-4-yl)-5-[(2-morpholin-4-ylethylamino)methyl]pyrazole-4-carboxylate Traditional Name: 1-(7-chloro-4-quinolyl)-5-[(2-morpholinoethylamino)methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C22H26ClN5O3 MolecularWeight: 443.92654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C3C=CC(=CC3=NC=C2)Cl)CNCCN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C3C=CC(=CC3=NC=C2)Cl)CNCCN4CCOCC4

InChI

InChI=1S/C22H26ClN5O3/c1-2-31-22(29)18-14-26-28(20-5-6-25-19-13-16(23)3-4-17(19)20)21(18)15-24-7-8-27-9-11-30-12-10-27/h3-6,13-14,24H,2,7-12,15H2,1H3