[2-(3-bromophenyl)-2-oxidanylidene-ethyl] 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: [2-(3-bromophenyl)-2-oxidanylidene-ethyl] 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: [2-(3-bromophenyl)-2-oxo-ethyl] 2-(5-phenyltetrazol-2-yl)acetate CAS Name: 2-(5-phenyl-2-tetrazolyl)acetic acid [2-(3-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromophenyl)-2-oxoethyl] 2-(5-phenyltetrazol-2-yl)acetate Traditional Name: 2-(5-phenyltetrazol-2-yl)acetic acid [2-(3-bromophenyl)-2-keto-ethyl] ester Formula: C17H13BrN4O3 MolecularWeight: 401.21412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H13BrN4O3/c18-14-8-4-7-13(9-14)15(23)11-25-16(24)10-22-20-17(19-21-22)12-5-2-1-3-6-12/h1-9H,10-11H2