(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 4-phenoxybenzoate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 4-phenoxybenzoate Openeye Name: (1-propyltetrazol-5-yl)methyl 4-phenoxybenzoate CAS Name: 4-phenoxybenzoic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 4-phenoxybenzoate Traditional Name: 4-phenoxybenzoic acid (1-propyltetrazol-5-yl)methyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

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