ethyl 5-(2-chloranylethanoylamino)-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(2-chloranylethanoylamino)-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(2-chloroacetyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[(2-chloro-1-oxoethyl)amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-chloroacetyl)amino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[(2-chloroacetyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C17H15ClN4O3 MolecularWeight: 358.779

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)CCl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)CCl

InChI

InChI=1S/C17H15ClN4O3/c1-2-25-17(24)12-10-19-22(16(12)21-15(23)9-18)14-8-7-11-5-3-4-6-13(11)20-14/h3-8,10H,2,9H2,1H3,(H,21,23)