1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-4-(2-methylpropyl)-1,4-diazepan-5-one

Systemtic Name: 1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-4-(2-methylpropyl)-1,4-diazepan-5-one Openeye Name: 1-[(2-fluoro-4-methoxy-phenyl)methyl]-4-isobutyl-1,4-diazepan-5-one CAS Name: 1-[(2-fluoro-4-methoxyphenyl)methyl]-4-(2-methylpropyl)-1,4-diazepan-5-one IUPAC Name: 1-[(2-fluoro-4-methoxyphenyl)methyl]-4-(2-methylpropyl)-1,4-diazepan-5-one Traditional Name: 1-(2-fluoro-4-methoxy-benzyl)-4-isobutyl-1,4-diazepan-5-one Formula: C17H25FN2O2 MolecularWeight: 308.391003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CCC1=O)CC2=C(C=C(C=C2)OC)F

Isomeric SMILES

CC(C)CN1CCN(CCC1=O)CC2=C(C=C(C=C2)OC)F

InChI

InChI=1S/C17H25FN2O2/c1-13(2)11-20-9-8-19(7-6-17(20)21)12-14-4-5-15(22-3)10-16(14)18/h4-5,10,13H,6-9,11-12H2,1-3H3