(3R)-3-(benzotriazol-1-yl)heptanal

Systemtic Name: (3R)-3-(benzotriazol-1-yl)heptanal Openeye Name: (3R)-3-(benzotriazol-1-yl)heptanal CAS Name: (3R)-3-(1-benzotriazolyl)heptanal IUPAC Name: (3R)-3-(benzotriazol-1-yl)heptanal Traditional Name: (3R)-3-(benzotriazol-1-yl)enanthaldehyde Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC=O)N1C2=CC=CC=C2N=N1

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-2-3-6-11(9-10-17)16-13-8-5-4-7-12(13)14-15-16/h4-5,7-8,10-11H,2-3,6,9H2,1H3/t11-/m1/s1