3-azanyl-5-(2-fluoranylhexyl)-1-methyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-5-(2-fluoranylhexyl)-1-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-5-(2-fluorohexyl)-1-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-5-(2-fluorohexyl)-1-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-5-(2-fluorohexyl)-1-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-5-(2-fluorohexyl)-1-methyl-3H-1,4-benzodiazepin-2-one Formula: C16H22FN3O MolecularWeight: 291.363783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=NC(C(=O)N(C2=CC=CC=C21)C)N)F

Isomeric SMILES

CCCCC(CC1=NC(C(=O)N(C2=CC=CC=C21)C)N)F

InChI

InChI=1S/C16H22FN3O/c1-3-4-7-11(17)10-13-12-8-5-6-9-14(12)20(2)16(21)15(18)19-13/h5-6,8-9,11,15H,3-4,7,10,18H2,1-2H3