2-[5-(3-fluorophenyl)-1,2,3,4-tetrazol-2-yl]-N-(2-oxidanylideneazepan-3-yl)ethanamide

Systemtic Name: 2-[5-(3-fluorophenyl)-1,2,3,4-tetrazol-2-yl]-N-(2-oxidanylideneazepan-3-yl)ethanamide Openeye Name: 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(2-oxoazepan-3-yl)acetamide CAS Name: 2-[5-(3-fluorophenyl)-2-tetrazolyl]-N-(2-oxo-3-azepanyl)acetamide IUPAC Name: 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(2-oxoazepan-3-yl)acetamide Traditional Name: 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-(2-ketoazepan-3-yl)acetamide Formula: C15H17FN6O2 MolecularWeight: 332.332883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)CN2N=C(N=N2)C3=CC(=CC=C3)F

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)CN2N=C(N=N2)C3=CC(=CC=C3)F

InChI

InChI=1S/C15H17FN6O2/c16-11-5-3-4-10(8-11)14-19-21-22(20-14)9-13(23)18-12-6-1-2-7-17-15(12)24/h3-5,8,12H,1-2,6-7,9H2,(H,17,24)(H,18,23)