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

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 3-butoxybenzoate Openeye Name: [4-(tetrazol-1-yl)phenyl] 3-butoxybenzoate CAS Name: 3-butoxybenzoic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 3-butoxybenzoate Traditional Name: 3-butoxybenzoic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C18H18N4O3/c1-2-3-11-24-17-6-4-5-14(12-17)18(23)25-16-9-7-15(8-10-16)22-13-19-20-21-22/h4-10,12-13H,2-3,11H2,1H3