[4-(1,2,3,4-tetrazol-1-yl)phenyl] 3-phenylpropanoate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 3-phenylpropanoate Openeye Name: [4-(tetrazol-1-yl)phenyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C16H14N4O2 MolecularWeight: 294.30796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)OC2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)OC2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C16H14N4O2/c21-16(11-6-13-4-2-1-3-5-13)22-15-9-7-14(8-10-15)20-12-17-18-19-20/h1-5,7-10,12H,6,11H2