6-(4-oxidanylidenechromen-2-yl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide

Systemtic Name: 6-(4-oxidanylidenechromen-2-yl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide Openeye Name: 6-(4-oxochromen-2-yl)-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide CAS Name: 6-(4-oxo-1-benzopyran-2-yl)-N-(3-pyridinylmethyl)-2,3-dihydro-1,4-benzodioxin-2-carboxamide IUPAC Name: 6-(4-oxochromen-2-yl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide Traditional Name: 6-(4-ketochromen-2-yl)-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxin-2-carboxamide Formula: C24H18N2O5 MolecularWeight: 414.41012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(O1)C=C(C=C2)C3=CC(=O)C4=CC=CC=C4O3)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1C(OC2=C(O1)C=C(C=C2)C3=CC(=O)C4=CC=CC=C4O3)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C24H18N2O5/c27-18-11-21(30-19-6-2-1-5-17(18)19)16-7-8-20-22(10-16)29-14-23(31-20)24(28)26-13-15-4-3-9-25-12-15/h1-12,23H,13-14H2,(H,26,28)