ethyl 2-(4,5,6,7-tetrahydrobenzotriazol-1-yl)propanoate

Systemtic Name: ethyl 2-(4,5,6,7-tetrahydrobenzotriazol-1-yl)propanoate Openeye Name: ethyl 2-(4,5,6,7-tetrahydrobenzotriazol-1-yl)propanoate CAS Name: 2-(4,5,6,7-tetrahydrobenzotriazol-1-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(4,5,6,7-tetrahydrobenzotriazol-1-yl)propanoate Traditional Name: 2-(4,5,6,7-tetrahydrobenzotriazol-1-yl)propionic acid ethyl ester Formula: C11H17N3O2 MolecularWeight: 223.27158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1C2=C(CCCC2)N=N1

Isomeric SMILES

CCOC(=O)C(C)N1C2=C(CCCC2)N=N1

InChI

InChI=1S/C11H17N3O2/c1-3-16-11(15)8(2)14-10-7-5-4-6-9(10)12-13-14/h8H,3-7H2,1-2H3