2-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl]-5-(3-methoxyphenyl)-1,2,3,4-tetrazole

Systemtic Name: 2-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl]-5-(3-methoxyphenyl)-1,2,3,4-tetrazole Openeye Name: 2-[(4-bromo-2,5-dimethoxy-phenyl)methyl]-5-(3-methoxyphenyl)tetrazole CAS Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methyl]-5-(3-methoxyphenyl)tetrazole IUPAC Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methyl]-5-(3-methoxyphenyl)tetrazole Traditional Name: 2-(4-bromo-2,5-dimethoxy-benzyl)-5-(3-methoxyphenyl)tetrazole Formula: C17H17BrN4O3 MolecularWeight: 405.24588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(N=N2)CC3=CC(=C(C=C3OC)Br)OC

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(N=N2)CC3=CC(=C(C=C3OC)Br)OC

InChI

InChI=1S/C17H17BrN4O3/c1-23-13-6-4-5-11(7-13)17-19-21-22(20-17)10-12-8-16(25-3)14(18)9-15(12)24-2/h4-9H,10H2,1-3H3