2-(3-bromanylphenoxy)ethyl 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: 2-(3-bromophenoxy)ethyl 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid 2-(3-bromophenoxy)ethyl ester Formula: C16H13BrN4O3 MolecularWeight: 389.20342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=NN=N2)C(=O)OCCOC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)N2C=NN=N2)C(=O)OCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H13BrN4O3/c17-13-4-2-6-15(10-13)23-7-8-24-16(22)12-3-1-5-14(9-12)21-11-18-19-20-21/h1-6,9-11H,7-8H2