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

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C11H14BrN5O2 MolecularWeight: 328.16516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C11H14BrN5O2/c1-2-3-4-17-10(14-15-16-17)7-19-11(18)9-5-8(12)6-13-9/h5-6,13H,2-4,7H2,1H3