3-[5-(diphenylmethyl)-1,2,3-triazol-1-yl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanoic acid

Systemtic Name: 3-[5-(diphenylmethyl)-1,2,3-triazol-1-yl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanoic acid Openeye Name: 3-(5-benzhydryltriazol-1-yl)-2-tetralin-5-yloxy-propanoic acid CAS Name: 3-[5-(diphenylmethyl)-1-triazolyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanoic acid IUPAC Name: 3-(5-benzhydryltriazol-1-yl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanoic acid Traditional Name: 3-(5-benzhydryltriazol-1-yl)-2-tetralin-5-yloxy-propionic acid Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC=C2OC(CN3C(=CN=N3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C=CC=C2OC(CN3C(=CN=N3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C28H27N3O3/c32-28(33)26(34-25-17-9-15-20-10-7-8-16-23(20)25)19-31-24(18-29-30-31)27(21-11-3-1-4-12-21)22-13-5-2-6-14-22/h1-6,9,11-15,17-18,26-27H,7-8,10,16,19H2,(H,32,33)