methyl 4-(benzotriazol-1-yl)butanoate

Systemtic Name: methyl 4-(benzotriazol-1-yl)butanoate Openeye Name: methyl 4-(benzotriazol-1-yl)butanoate CAS Name: 4-(1-benzotriazolyl)butanoic acid methyl ester IUPAC Name: methyl 4-(benzotriazol-1-yl)butanoate Traditional Name: 4-(benzotriazol-1-yl)butyric acid methyl ester Formula: C11H13N3O2 MolecularWeight: 219.23982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C2=CC=CC=C2N=N1

Isomeric SMILES

COC(=O)CCCN1C2=CC=CC=C2N=N1

InChI

InChI=1S/C11H13N3O2/c1-16-11(15)7-4-8-14-10-6-3-2-5-9(10)12-13-14/h2-3,5-6H,4,7-8H2,1H3