2-(3,5-dimethylphenoxy)ethyl 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)C2=CC=C(C=C2)N3C=NN=N3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)C2=CC=C(C=C2)N3C=NN=N3)C

InChI

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