[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 4-methoxy-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 4-methoxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 4-methoxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-methoxy-1-phenyl-3-pyrazolecarboxylic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 4-methoxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-methoxy-1-phenyl-pyrazole-3-carboxylic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C21H19N3O4 MolecularWeight: 377.39326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)OC2=CC=C(C=C2)N3CCCC3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)OC2=CC=C(C=C2)N3CCCC3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O4/c1-27-18-14-24(16-6-3-2-4-7-16)22-20(18)21(26)28-17-11-9-15(10-12-17)23-13-5-8-19(23)25/h2-4,6-7,9-12,14H,5,8,13H2,1H3