[4-(thiophen-2-ylcarbonylamino)phenyl] 1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxylate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxylate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxylate CAS Name: 1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxylic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxylate Traditional Name: 1-[(E)-3-phenylacryloyl]isonipecotic acid [4-(2-thenoylamino)phenyl] ester Formula: C26H24N2O4S MolecularWeight: 460.54476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O4S/c29-24(13-8-19-5-2-1-3-6-19)28-16-14-20(15-17-28)26(31)32-22-11-9-21(10-12-22)27-25(30)23-7-4-18-33-23/h1-13,18,20H,14-17H2,(H,27,30)/b13-8+