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

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] pentanoate Openeye Name: [4-(tetrazol-1-yl)phenyl] pentanoate CAS Name: pentanoic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] pentanoate Traditional Name: valeric acid [4-(tetrazol-1-yl)phenyl] ester Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC=C(C=C1)N2C=NN=N2

Isomeric SMILES

CCCCC(=O)OC1=CC=C(C=C1)N2C=NN=N2

InChI

InChI=1S/C12H14N4O2/c1-2-3-4-12(17)18-11-7-5-10(6-8-11)16-9-13-14-15-16/h5-9H,2-4H2,1H3