2-(4-morpholin-4-ylsulfonylphenoxy)ethyl 3-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: 2-(4-morpholin-4-ylsulfonylphenoxy)ethyl 3-phenyl-1H-pyrazole-5-carboxylate Openeye Name: 2-(4-morpholinosulfonylphenoxy)ethyl 3-phenyl-1H-pyrazole-5-carboxylate CAS Name: 3-phenyl-1H-pyrazole-5-carboxylic acid 2-[4-(4-morpholinylsulfonyl)phenoxy]ethyl ester IUPAC Name: 2-(4-morpholin-4-ylsulfonylphenoxy)ethyl 3-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 3-phenyl-1H-pyrazole-5-carboxylic acid 2-(4-morpholinosulfonylphenoxy)ethyl ester Formula: C22H23N3O6S MolecularWeight: 457.49952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)OCCOC(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)OCCOC(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O6S/c26-22(21-16-20(23-24-21)17-4-2-1-3-5-17)31-15-14-30-18-6-8-19(9-7-18)32(27,28)25-10-12-29-13-11-25/h1-9,16H,10-15H2,(H,23,24)