4-(furan-2-ylmethyl)-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(furan-2-ylmethyl)-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(2-furylmethyl)-6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one CAS Name: 4-(2-furanylmethyl)-1-(4-oxanylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(furan-2-ylmethyl)-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(2-furfuryl)-6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one Formula: C22H29N3O4 MolecularWeight: 399.48336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CN2CC(CN(CC2=O)CC3=CC=CO3)OCC4=CC=NC=C4

Isomeric SMILES

C1COCCC1CN2CC(CN(CC2=O)CC3=CC=CO3)OCC4=CC=NC=C4

InChI

InChI=1S/C22H29N3O4/c26-22-16-24(13-20-2-1-9-28-20)14-21(29-17-19-3-7-23-8-4-19)15-25(22)12-18-5-10-27-11-6-18/h1-4,7-9,18,21H,5-6,10-17H2