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

Systemtic Name: 2-[4,4-bis[4-(quinolin-2-ylmethoxy)phenyl]cyclohexyl]-1,2-oxaziridine-3-carboxylic acid Openeye Name: 2-[4,4-bis[4-(2-quinolylmethoxy)phenyl]cyclohexyl]oxaziridine-3-carboxylic acid CAS Name: 2-[4,4-bis[4-(2-quinolinylmethoxy)phenyl]cyclohexyl]-3-oxaziridinecarboxylic acid IUPAC Name: 2-[4,4-bis[4-(quinolin-2-ylmethoxy)phenyl]cyclohexyl]oxaziridine-3-carboxylic acid Traditional Name: 2-[4,4-bis[4-(2-quinolylmethoxy)phenyl]cyclohexyl]oxaziridine-3-carboxylic acid Formula: C40H35N3O5 MolecularWeight: 637.723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2C(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(CCC1N2C(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/C40H35N3O5/c44-39(45)38-43(48-38)33-21-23-40(24-22-33,29-11-17-34(18-12-29)46-25-31-15-9-27-5-1-3-7-36(27)41-31)30-13-19-35(20-14-30)47-26-32-16-10-28-6-2-4-8-37(28)42-32/h1-20,33,38H,21-26H2,(H,44,45)