ethyl 5-(5-chloranylquinolin-8-yl)oxysulfonyl-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(5-chloranylquinolin-8-yl)oxysulfonyl-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(5-chloro-8-quinolyl)oxysulfonyl]-1H-pyrazole-4-carboxylate CAS Name: 5-[(5-chloro-8-quinolinyl)oxysulfonyl]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(5-chloroquinolin-8-yl)oxysulfonyl-1H-pyrazole-4-carboxylate Traditional Name: 5-[(5-chloro-8-quinolyl)oxysulfonyl]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C15H12ClN3O5S MolecularWeight: 381.79088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C15H12ClN3O5S/c1-2-23-15(20)10-8-18-19-14(10)25(21,22)24-12-6-5-11(16)9-4-3-7-17-13(9)12/h3-8H,2H2,1H3,(H,18,19)