(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)OCC2=NN=C(O2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)OCC2=NN=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3O4/c21-15-9-5-2-6-10-20(15)11-16(22)23-12-14-18-19-17(24-14)13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2