[4-(3-azanylpropyl)-1,4-diazepan-1-yl]-(3-fluoranyl-4-methyl-phenyl)methanone

Systemtic Name: [4-(3-azanylpropyl)-1,4-diazepan-1-yl]-(3-fluoranyl-4-methyl-phenyl)methanone Openeye Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(3-fluoro-4-methyl-phenyl)methanone CAS Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(3-fluoro-4-methylphenyl)methanone IUPAC Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(3-fluoro-4-methylphenyl)methanone Traditional Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(3-fluoro-4-methyl-phenyl)methanone Formula: C16H24FN3O MolecularWeight: 293.379663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CCCN)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CCCN)F

InChI

InChI=1S/C16H24FN3O/c1-13-4-5-14(12-15(13)17)16(21)20-9-3-8-19(10-11-20)7-2-6-18/h4-5,12H,2-3,6-11,18H2,1H3