4-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-1-methyl-3-(1,2,3,4-tetrazol-2-yl)pyridin-2-one

Systemtic Name: 4-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-1-methyl-3-(1,2,3,4-tetrazol-2-yl)pyridin-2-one Openeye Name: 4-[2-(2-benzyloxy-5-bromo-phenyl)ethyl]-1-methyl-3-(tetrazol-2-yl)pyridin-2-one CAS Name: 4-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl]-1-methyl-3-(2-tetrazolyl)-2-pyridinone IUPAC Name: 4-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl]-1-methyl-3-(tetrazol-2-yl)pyridin-2-one Traditional Name: 4-[2-(2-benzoxy-5-bromo-phenyl)ethyl]-1-methyl-3-(tetrazol-2-yl)-2-pyridone Formula: C22H20BrN5O2 MolecularWeight: 466.3305

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C(C1=O)N2N=CN=N2)CCC3=C(C=CC(=C3)Br)OCC4=CC=CC=C4

Isomeric SMILES

CN1C=CC(=C(C1=O)N2N=CN=N2)CCC3=C(C=CC(=C3)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C22H20BrN5O2/c1-27-12-11-17(21(22(27)29)28-25-15-24-26-28)7-8-18-13-19(23)9-10-20(18)30-14-16-5-3-2-4-6-16/h2-6,9-13,15H,7-8,14H2,1H3