ethyl 4-[[2-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butyl]-1,2,3,4-tetrazol-5-yl]methyl]benzoate

Systemtic Name: ethyl 4-[[2-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butyl]-1,2,3,4-tetrazol-5-yl]methyl]benzoate Openeye Name: ethyl 4-[[2-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butyl]tetrazol-5-yl]methyl]benzoate CAS Name: 4-[[2-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butyl]-5-tetrazolyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butyl]tetrazol-5-yl]methyl]benzoate Traditional Name: 4-[[2-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butyl]tetrazol-5-yl]methyl]benzoic acid ethyl ester Formula: C26H32N4O5 MolecularWeight: 480.55608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCN2N=C(N=N2)CC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCN2N=C(N=N2)CC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C26H32N4O5/c1-4-8-22-23(14-13-21(18(3)31)25(22)32)35-16-7-6-15-30-28-24(27-29-30)17-19-9-11-20(12-10-19)26(33)34-5-2/h9-14,32H,4-8,15-17H2,1-3H3