(2-chloranylquinolin-3-yl)methyl 1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: (2-chloro-3-quinolyl)methyl 1-benzylpyrazole-4-carboxylate CAS Name: 1-(phenylmethyl)-4-pyrazolecarboxylic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 1-benzylpyrazole-4-carboxylate Traditional Name: 1-benzylpyrazole-4-carboxylic acid (2-chloro-3-quinolyl)methyl ester Formula: C21H16ClN3O2 MolecularWeight: 377.82364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)OCC3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)OCC3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C21H16ClN3O2/c22-20-17(10-16-8-4-5-9-19(16)24-20)14-27-21(26)18-11-23-25(13-18)12-15-6-2-1-3-7-15/h1-11,13H,12,14H2