3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]cyclopentane-1-carboxylic acid

Systemtic Name: 3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]cyclopentane-1-carboxylic acid Openeye Name: 3,3-bis[4-(2-quinolylmethoxy)phenyl]cyclopentanecarboxylic acid CAS Name: 3,3-bis[4-(2-quinolinylmethoxy)phenyl]-1-cyclopentanecarboxylic acid IUPAC Name: 3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]cyclopentane-1-carboxylic acid Traditional Name: 3,3-bis[4-(2-quinolylmethoxy)phenyl]cyclopentanecarboxylic acid Formula: C38H32N2O4 MolecularWeight: 580.67168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1C(=O)O)(C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)OCC6=NC7=CC=CC=C7C=C6

Isomeric SMILES

C1CC(CC1C(=O)O)(C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)OCC6=NC7=CC=CC=C7C=C6

InChI

InChI=1S/C38H32N2O4/c41-37(42)28-21-22-38(23-28,29-11-17-33(18-12-29)43-24-31-15-9-26-5-1-3-7-35(26)39-31)30-13-19-34(20-14-30)44-25-32-16-10-27-6-2-4-8-36(27)40-32/h1-20,28H,21-25H2,(H,41,42)