tert-butyl 4-(1H-indazol-3-ylcarbonylamino)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: tert-butyl 4-(1H-indazol-3-ylcarbonylamino)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate Openeye Name: tert-butyl 4-(1H-indazole-3-carbonylamino)-5-oxo-1-phenyl-pyrrolidine-3-carboxylate CAS Name: 4-[[1H-indazol-3-yl(oxo)methyl]amino]-5-oxo-1-phenyl-3-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1H-indazole-3-carbonylamino)-5-oxo-1-phenylpyrrolidine-3-carboxylate Traditional Name: 4-(1H-indazole-3-carbonylamino)-5-keto-1-phenyl-pyrrolidine-3-carboxylic acid tert-butyl ester Formula: C23H24N4O4 MolecularWeight: 420.46106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CN(C(=O)C1NC(=O)C2=NNC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)C1CN(C(=O)C1NC(=O)C2=NNC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O4/c1-23(2,3)31-22(30)16-13-27(14-9-5-4-6-10-14)21(29)19(16)24-20(28)18-15-11-7-8-12-17(15)25-26-18/h4-12,16,19H,13H2,1-3H3,(H,24,28)(H,25,26)