[4-(1,2,3,4-tetrazol-1-yl)phenyl] 3,4,5-triethoxybenzoate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 3,4,5-triethoxybenzoate Openeye Name: [4-(tetrazol-1-yl)phenyl] 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C20H22N4O5/c1-4-26-17-11-14(12-18(27-5-2)19(17)28-6-3)20(25)29-16-9-7-15(8-10-16)24-13-21-22-23-24/h7-13H,4-6H2,1-3H3