4-[[5-(hydroxymethyl)furan-2-yl]methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-[[5-(hydroxymethyl)furan-2-yl]methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-[[5-(hydroxymethyl)-2-furyl]methyl]-1-isobutyl-1,4-diazepan-2-one CAS Name: 4-[[5-(hydroxymethyl)-2-furanyl]methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-[[5-(hydroxymethyl)furan-2-yl]methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-isobutyl-4-[(5-methylol-2-furyl)methyl]-1,4-diazepan-2-one Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)CC2=CC=C(O2)CO)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)CC2=CC=C(O2)CO)OCC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O4/c1-17(2)10-24-13-21(27-16-18-6-4-3-5-7-18)12-23(14-22(24)26)11-19-8-9-20(15-25)28-19/h3-9,17,21,25H,10-16H2,1-2H3