(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: (1-phenyltetrazol-5-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C13H10BrN5O2 MolecularWeight: 348.1548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC(=CN3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C13H10BrN5O2/c14-9-6-11(15-7-9)13(20)21-8-12-16-17-18-19(12)10-4-2-1-3-5-10/h1-7,15H,8H2