ethyl 2-(benzotriazol-1-yl)pentanoate

Systemtic Name: ethyl 2-(benzotriazol-1-yl)pentanoate Openeye Name: ethyl 2-(benzotriazol-1-yl)pentanoate CAS Name: 2-(1-benzotriazolyl)pentanoic acid ethyl ester IUPAC Name: ethyl 2-(benzotriazol-1-yl)pentanoate Traditional Name: 2-(benzotriazol-1-yl)valeric acid ethyl ester Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OCC)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CCCC(C(=O)OCC)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H17N3O2/c1-3-7-12(13(17)18-4-2)16-11-9-6-5-8-10(11)14-15-16/h5-6,8-9,12H,3-4,7H2,1-2H3