N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-carboxamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-carboxamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-oxo-6,7-dihydro-5H-benzofuran-3-carboxamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-pyrazolyl]-4-oxo-6,7-dihydro-5H-benzofuran-3-carboxamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-4-oxo-6,7-dihydro-5H-1-benzofuran-3-carboxamide Traditional Name: N-[1-(3-cyanobenzyl)pyrazol-4-yl]-4-keto-6,7-dihydro-5H-benzofuran-3-carboxamide Formula: C20H16N4O3 MolecularWeight: 360.36604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=CO2)C(=O)NC3=CN(N=C3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=CO2)C(=O)NC3=CN(N=C3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H16N4O3/c21-8-13-3-1-4-14(7-13)10-24-11-15(9-22-24)23-20(26)16-12-27-18-6-2-5-17(25)19(16)18/h1,3-4,7,9,11-12H,2,5-6,10H2,(H,23,26)