ethyl 5-(benzotriazol-1-yl)pentanoate

Systemtic Name: ethyl 5-(benzotriazol-1-yl)pentanoate Openeye Name: ethyl 5-(benzotriazol-1-yl)pentanoate CAS Name: 5-(1-benzotriazolyl)pentanoic acid ethyl ester IUPAC Name: ethyl 5-(benzotriazol-1-yl)pentanoate Traditional Name: 5-(benzotriazol-1-yl)valeric acid ethyl ester Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C2=CC=CC=C2N=N1

Isomeric SMILES

CCOC(=O)CCCCN1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H17N3O2/c1-2-18-13(17)9-5-6-10-16-12-8-4-3-7-11(12)14-15-16/h3-4,7-8H,2,5-6,9-10H2,1H3