1-oxidanylidene-3-phenyl-N-(pyridin-3-ylmethyl)-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: 1-oxidanylidene-3-phenyl-N-(pyridin-3-ylmethyl)-3,4-dihydroisochromene-6-carboxamide Openeye Name: 1-oxo-3-phenyl-N-(3-pyridylmethyl)isochromane-6-carboxamide CAS Name: 1-oxo-3-phenyl-N-(3-pyridinylmethyl)-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: 1-oxo-3-phenyl-N-(pyridin-3-ylmethyl)-3,4-dihydroisochromene-6-carboxamide Traditional Name: 1-keto-3-phenyl-N-(3-pyridylmethyl)isochroman-6-carboxamide Formula: C22H18N2O3 MolecularWeight: 358.38992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3/c25-21(24-14-15-5-4-10-23-13-15)17-8-9-19-18(11-17)12-20(27-22(19)26)16-6-2-1-3-7-16/h1-11,13,20H,12,14H2,(H,24,25)