1-[5-(3-methoxy-4-phenylmethoxy-phenyl)-1,2,3,4-tetrazol-2-yl]propan-2-one

Systemtic Name: 1-[5-(3-methoxy-4-phenylmethoxy-phenyl)-1,2,3,4-tetrazol-2-yl]propan-2-one Openeye Name: 1-[5-(4-benzyloxy-3-methoxy-phenyl)tetrazol-2-yl]propan-2-one CAS Name: 1-[5-(3-methoxy-4-phenylmethoxyphenyl)-2-tetrazolyl]-2-propanone IUPAC Name: 1-[5-(3-methoxy-4-phenylmethoxyphenyl)tetrazol-2-yl]propan-2-one Traditional Name: 1-[5-(4-benzoxy-3-methoxy-phenyl)tetrazol-2-yl]acetone Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1N=C(N=N1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

CC(=O)CN1N=C(N=N1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C18H18N4O3/c1-13(23)11-22-20-18(19-21-22)15-8-9-16(17(10-15)24-2)25-12-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3