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

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoate Openeye Name: (1-phenyltetrazol-5-yl)methyl 2-(5,6-dimethylbenzofuran-3-yl)acetate CAS Name: 2-(5,6-dimethyl-3-benzofuranyl)acetic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 2-(5,6-dimethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(5,6-dimethylbenzofuran-3-yl)acetic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)OCC3=NN=NN3C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)OCC3=NN=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C20H18N4O3/c1-13-8-17-15(11-26-18(17)9-14(13)2)10-20(25)27-12-19-21-22-23-24(19)16-6-4-3-5-7-16/h3-9,11H,10,12H2,1-2H3