(4-cyanophenyl)methyl 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (4-cyanophenyl)methyl 2-(5-phenyltetrazol-2-yl)acetate CAS Name: 2-(5-phenyl-2-tetrazolyl)acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(5-phenyltetrazol-2-yl)acetate Traditional Name: 2-(5-phenyltetrazol-2-yl)acetic acid (4-cyanobenzyl) ester Formula: C17H13N5O2 MolecularWeight: 319.31742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H13N5O2/c18-10-13-6-8-14(9-7-13)12-24-16(23)11-22-20-17(19-21-22)15-4-2-1-3-5-15/h1-9H,11-12H2