(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoate Openeye Name: (1-butyltetrazol-5-yl)methyl 2-(5,6-dimethylbenzofuran-3-yl)acetate CAS Name: 2-(5,6-dimethyl-3-benzofuranyl)acetic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 2-(5,6-dimethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(5,6-dimethylbenzofuran-3-yl)acetic acid (1-butyltetrazol-5-yl)methyl ester Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)CC2=COC3=CC(=C(C=C32)C)C

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)CC2=COC3=CC(=C(C=C32)C)C

InChI

InChI=1S/C18H22N4O3/c1-4-5-6-22-17(19-20-21-22)11-25-18(23)9-14-10-24-16-8-13(3)12(2)7-15(14)16/h7-8,10H,4-6,9,11H2,1-3H3