5-[5-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butyl]-1,2,3,4-tetrazol-1-yl]pentanoic acid

Systemtic Name: 5-[5-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butyl]-1,2,3,4-tetrazol-1-yl]pentanoic acid Openeye Name: 5-[5-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butyl]tetrazol-1-yl]pentanoic acid CAS Name: 5-[5-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butyl]-1-tetrazolyl]pentanoic acid IUPAC Name: 5-[5-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butyl]tetrazol-1-yl]pentanoic acid Traditional Name: 5-[5-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butyl]tetrazol-1-yl]valeric acid Formula: C21H30N4O5 MolecularWeight: 418.4867

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC2=NN=NN2CCCCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC2=NN=NN2CCCCC(=O)O

InChI

InChI=1S/C21H30N4O5/c1-3-8-17-18(12-11-16(15(2)26)21(17)29)30-14-7-5-9-19-22-23-24-25(19)13-6-4-10-20(27)28/h11-12,29H,3-10,13-14H2,1-2H3,(H,27,28)