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

Systemtic Name: 2-[3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]cyclopentyl]-1,2-oxaziridine-3-carboxylic acid Openeye Name: 2-[3,3-bis[4-(2-quinolylmethoxy)phenyl]cyclopentyl]oxaziridine-3-carboxylic acid CAS Name: 2-[3,3-bis[4-(2-quinolinylmethoxy)phenyl]cyclopentyl]-3-oxaziridinecarboxylic acid IUPAC Name: 2-[3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]cyclopentyl]oxaziridine-3-carboxylic acid Traditional Name: 2-[3,3-bis[4-(2-quinolylmethoxy)phenyl]cyclopentyl]oxaziridine-3-carboxylic acid Formula: C39H33N3O5 MolecularWeight: 623.69642

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1N2C(O2)C(=O)O)(C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C6=CC=C(C=C6)OCC7=NC8=CC=CC=C8C=C7

Isomeric SMILES

C1CC(CC1N2C(O2)C(=O)O)(C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C6=CC=C(C=C6)OCC7=NC8=CC=CC=C8C=C7

InChI

InChI=1S/C39H33N3O5/c43-38(44)37-42(47-37)32-21-22-39(23-32,28-11-17-33(18-12-28)45-24-30-15-9-26-5-1-3-7-35(26)40-30)29-13-19-34(20-14-29)46-25-31-16-10-27-6-2-4-8-36(27)41-31/h1-20,32,37H,21-25H2,(H,43,44)