ethyl 1-[5-bromanyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-bromanyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-bromo-2-(tetrazol-1-yl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[5-bromo-2-(1-tetrazolyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-bromo-2-(tetrazol-1-yl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[5-bromo-2-(tetrazol-1-yl)benzoyl]isonipecotic acid ethyl ester Formula: C16H18BrN5O3 MolecularWeight: 408.24982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)Br)N3C=NN=N3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)Br)N3C=NN=N3

InChI

InChI=1S/C16H18BrN5O3/c1-2-25-16(24)11-5-7-21(8-6-11)15(23)13-9-12(17)3-4-14(13)22-10-18-19-20-22/h3-4,9-11H,2,5-8H2,1H3