dimethyl 2-bromanyl-5-(5-phenyl-1,2,3,4-tetrazol-2-yl)hexanedioate

Systemtic Name: dimethyl 2-bromanyl-5-(5-phenyl-1,2,3,4-tetrazol-2-yl)hexanedioate Openeye Name: dimethyl 2-bromo-5-(5-phenyltetrazol-2-yl)hexanedioate CAS Name: 2-bromo-5-(5-phenyl-2-tetrazolyl)hexanedioic acid dimethyl ester IUPAC Name: dimethyl 2-bromo-5-(5-phenyltetrazol-2-yl)hexanedioate Traditional Name: 2-bromo-5-(5-phenyltetrazol-2-yl)adipic acid dimethyl ester Formula: C15H17BrN4O4 MolecularWeight: 397.22388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(C(=O)OC)Br)N1N=C(N=N1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CCC(C(=O)OC)Br)N1N=C(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C15H17BrN4O4/c1-23-14(21)11(16)8-9-12(15(22)24-2)20-18-13(17-19-20)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3