6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(5-oxidanylidenepyrrolidin-3-yl)carbonyl-1,4-diazepan-2-one

Systemtic Name: 6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(5-oxidanylidenepyrrolidin-3-yl)carbonyl-1,4-diazepan-2-one Openeye Name: 6-[(3-fluorophenyl)methoxy]-1-isobutyl-4-(5-oxopyrrolidine-3-carbonyl)-1,4-diazepan-2-one CAS Name: 6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-[oxo-(5-oxo-3-pyrrolidinyl)methyl]-1,4-diazepan-2-one IUPAC Name: 6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(5-oxopyrrolidine-3-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-(3-fluorobenzyl)oxy-1-isobutyl-4-(5-ketopyrrolidine-3-carbonyl)-1,4-diazepan-2-one Formula: C21H28FN3O4 MolecularWeight: 405.463123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)C2CC(=O)NC2)OCC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2CC(=O)NC2)OCC3=CC(=CC=C3)F

InChI

InChI=1S/C21H28FN3O4/c1-14(2)9-24-10-18(29-13-15-4-3-5-17(22)6-15)11-25(12-20(24)27)21(28)16-7-19(26)23-8-16/h3-6,14,16,18H,7-13H2,1-2H3,(H,23,26)