(3-azanyl-4-fluoranyl-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (3-azanyl-4-fluoranyl-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Openeye Name: (3-amino-4-fluoro-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone CAS Name: (3-amino-4-fluorophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone IUPAC Name: (3-amino-4-fluorophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Traditional Name: (3-amino-4-fluoro-phenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Formula: C13H18FN3O MolecularWeight: 251.299923

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)C2=CC(=C(C=C2)F)N

Isomeric SMILES

CN1CCCN(CC1)C(=O)C2=CC(=C(C=C2)F)N

InChI

InChI=1S/C13H18FN3O/c1-16-5-2-6-17(8-7-16)13(18)10-3-4-11(14)12(15)9-10/h3-4,9H,2,5-8,15H2,1H3