[4-(1,2,3,4-tetrazol-1-yl)phenyl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [4-(tetrazol-1-yl)phenyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C15H11BrN4O3 MolecularWeight: 375.17684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCC(=O)OC2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCC(=O)OC2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C15H11BrN4O3/c16-11-2-1-3-14(8-11)22-9-15(21)23-13-6-4-12(5-7-13)20-10-17-18-19-20/h1-8,10H,9H2