4-(furan-3-ylmethyl)-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-(furan-3-ylmethyl)-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-(3-furylmethyl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-(3-furanylmethyl)-6-phenylmethoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-(furan-3-ylmethyl)-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-(3-furfuryl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1CC2=COC=C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C(CN(C(=O)CN1CC2=COC=C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c27-23-16-25(12-21-8-10-28-17-21)14-22(29-18-19-5-2-1-3-6-19)15-26(23)13-20-7-4-9-24-11-20/h1-11,17,22H,12-16,18H2