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

Systemtic Name: ethyl 1-(7-chloranylquinolin-4-yl)-5-[(2-methoxyethylamino)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(7-chloro-4-quinolyl)-5-[(2-methoxyethylamino)methyl]pyrazole-4-carboxylate CAS Name: 1-(7-chloro-4-quinolinyl)-5-[(2-methoxyethylamino)methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(7-chloroquinolin-4-yl)-5-[(2-methoxyethylamino)methyl]pyrazole-4-carboxylate Traditional Name: 1-(7-chloro-4-quinolyl)-5-[(2-methoxyethylamino)methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN4O3/c1-3-27-19(25)15-11-23-24(18(15)12-21-8-9-26-2)17-6-7-22-16-10-13(20)4-5-14(16)17/h4-7,10-11,21H,3,8-9,12H2,1-2H3