(5-ethanoyl-2-methoxy-phenyl)methyl 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O4/c1-12(23)13-6-7-17(25-2)15(8-13)10-26-18(24)14-4-3-5-16(9-14)22-11-19-20-21-22/h3-9,11H,10H2,1-2H3