[(1R)-1-(benzotriazol-1-yl)butyl] hexanoate

Systemtic Name: [(1R)-1-(benzotriazol-1-yl)butyl] hexanoate Openeye Name: [(1R)-1-(benzotriazol-1-yl)butyl] hexanoate CAS Name: hexanoic acid [(1R)-1-(1-benzotriazolyl)butyl] ester IUPAC Name: [(1R)-1-(benzotriazol-1-yl)butyl] hexanoate Traditional Name: hexanoic acid [(1R)-1-(benzotriazol-1-yl)butyl] ester Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(CCC)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CCCCCC(=O)O[C@H](CCC)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C16H23N3O2/c1-3-5-6-12-16(20)21-15(9-4-2)19-14-11-8-7-10-13(14)17-18-19/h7-8,10-11,15H,3-6,9,12H2,1-2H3/t15-/m1/s1