4-[(5-methylfuran-2-yl)methyl]-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-[(5-methylfuran-2-yl)methyl]-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-[(5-methyl-2-furyl)methyl]-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1,4-diazepan-2-one CAS Name: 4-[(5-methyl-2-furanyl)methyl]-1-[3-(2-oxo-1-pyrrolidinyl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-[(5-methylfuran-2-yl)methyl]-1-[3-(2-oxopyrrolidin-1-yl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-[3-(2-ketopyrrolidino)propyl]-4-[(5-methyl-2-furyl)methyl]-1,4-diazepan-2-one Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2CC(CN(C(=O)C2)CCCN3CCCC3=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)CN2CC(CN(C(=O)C2)CCCN3CCCC3=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O4/c1-20-10-11-22(32-20)15-26-16-23(31-19-21-7-3-2-4-8-21)17-28(25(30)18-26)14-6-13-27-12-5-9-24(27)29/h2-4,7-8,10-11,23H,5-6,9,12-19H2,1H3