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

Systemtic Name: methyl 1-[5-bromanyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[5-bromo-2-(tetrazol-1-yl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[5-bromo-2-(1-tetrazolyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[5-bromo-2-(tetrazol-1-yl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[5-bromo-2-(tetrazol-1-yl)benzoyl]isonipecotic acid methyl ester Formula: C15H16BrN5O3 MolecularWeight: 394.22324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16BrN5O3/c1-24-15(23)10-4-6-20(7-5-10)14(22)12-8-11(16)2-3-13(12)21-9-17-18-19-21/h2-3,8-10H,4-7H2,1H3