O1-tert-butyl O2-[4-(thiophen-2-ylcarbonylamino)phenyl] pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[4-(thiophen-2-ylcarbonylamino)phenyl] pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[4-(thiophene-2-carbonylamino)phenyl] pyrrolidine-1,2-dicarboxylate CAS Name: pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[4-(thiophene-2-carbonylamino)phenyl] pyrrolidine-1,2-dicarboxylate Traditional Name: pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[4-(2-thenoylamino)phenyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H24N2O5S/c1-21(2,3)28-20(26)23-12-4-6-16(23)19(25)27-15-10-8-14(9-11-15)22-18(24)17-7-5-13-29-17/h5,7-11,13,16H,4,6,12H2,1-3H3,(H,22,24)