ethyl 1-(7-chloranylquinolin-4-yl)-5-[(3-morpholin-4-ylpropylamino)methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(7-chloranylquinolin-4-yl)-5-[(3-morpholin-4-ylpropylamino)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(7-chloro-4-quinolyl)-5-[(3-morpholinopropylamino)methyl]pyrazole-4-carboxylate CAS Name: 1-(7-chloro-4-quinolinyl)-5-[[3-(4-morpholinyl)propylamino]methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(7-chloroquinolin-4-yl)-5-[(3-morpholin-4-ylpropylamino)methyl]pyrazole-4-carboxylate Traditional Name: 1-(7-chloro-4-quinolyl)-5-[(3-morpholinopropylamino)methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H28ClN5O3 MolecularWeight: 457.95312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C3C=CC(=CC3=NC=C2)Cl)CNCCCN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C3C=CC(=CC3=NC=C2)Cl)CNCCCN4CCOCC4

InChI

InChI=1S/C23H28ClN5O3/c1-2-32-23(30)19-15-27-29(21-6-8-26-20-14-17(24)4-5-18(20)21)22(19)16-25-7-3-9-28-10-12-31-13-11-28/h4-6,8,14-15,25H,2-3,7,9-13,16H2,1H3