3,5-bis(oxidanyl)-7-(5-phenyl-3-propan-2-yl-1,2,3-triazol-4-yl)heptanoic acid

Systemtic Name: 3,5-bis(oxidanyl)-7-(5-phenyl-3-propan-2-yl-1,2,3-triazol-4-yl)heptanoic acid Openeye Name: 3,5-dihydroxy-7-(3-isopropyl-5-phenyl-triazol-4-yl)heptanoic acid CAS Name: 3,5-dihydroxy-7-(5-phenyl-3-propan-2-yl-4-triazolyl)heptanoic acid IUPAC Name: 3,5-dihydroxy-7-(5-phenyl-3-propan-2-yltriazol-4-yl)heptanoic acid Traditional Name: 3,5-dihydroxy-7-(3-isopropyl-5-phenyl-triazol-4-yl)enanthic acid Formula: C18H25N3O4 MolecularWeight: 347.4088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(N=N1)C2=CC=CC=C2)CCC(CC(CC(=O)O)O)O

Isomeric SMILES

CC(C)N1C(=C(N=N1)C2=CC=CC=C2)CCC(CC(CC(=O)O)O)O

InChI

InChI=1S/C18H25N3O4/c1-12(2)21-16(9-8-14(22)10-15(23)11-17(24)25)18(19-20-21)13-6-4-3-5-7-13/h3-7,12,14-15,22-23H,8-11H2,1-2H3,(H,24,25)