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

Systemtic Name: methyl 2-[[5-bromanyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[5-bromo-2-(tetrazol-1-yl)benzoyl]amino]benzoate CAS Name: 2-[[[5-bromo-2-(1-tetrazolyl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[5-bromo-2-(tetrazol-1-yl)benzoyl]amino]benzoate Traditional Name: 2-[[5-bromo-2-(tetrazol-1-yl)benzoyl]amino]benzoic acid methyl ester Formula: C16H12BrN5O3 MolecularWeight: 402.20218

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)Br)N3C=NN=N3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)Br)N3C=NN=N3

InChI

InChI=1S/C16H12BrN5O3/c1-25-16(24)11-4-2-3-5-13(11)19-15(23)12-8-10(17)6-7-14(12)22-9-18-20-21-22/h2-9H,1H3,(H,19,23)