3-(aminomethyl)-5-(2-fluorophenyl)-1,4-benzodiazepin-2-one

Systemtic Name: 3-(aminomethyl)-5-(2-fluorophenyl)-1,4-benzodiazepin-2-one Openeye Name: 3-(aminomethyl)-5-(2-fluorophenyl)-1,4-benzodiazepin-2-one CAS Name: 3-(aminomethyl)-5-(2-fluorophenyl)-1,4-benzodiazepin-2-one IUPAC Name: 3-(aminomethyl)-5-(2-fluorophenyl)-1,4-benzodiazepin-2-one Traditional Name: 3-(aminomethyl)-5-(2-fluorophenyl)-1,4-benzodiazepin-2-one Formula: C16H12FN3O MolecularWeight: 281.284383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=CC=CC3=NC(=O)C(=N2)CN)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=CC=CC3=NC(=O)C(=N2)CN)F

InChI

InChI=1S/C16H12FN3O/c17-12-7-3-1-5-10(12)15-11-6-2-4-8-13(11)20-16(21)14(9-18)19-15/h1-8H,9,18H2