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

Systemtic Name: 3-[2-cyclopentyl-2-[4-(quinolin-2-ylmethoxy)phenyl]ethyl]-1,2-oxaziridine-3-carboxylic acid Openeye Name: 3-[2-cyclopentyl-2-[4-(2-quinolylmethoxy)phenyl]ethyl]oxaziridine-3-carboxylic acid CAS Name: 3-[2-cyclopentyl-2-[4-(2-quinolinylmethoxy)phenyl]ethyl]-3-oxaziridinecarboxylic acid IUPAC Name: 3-[2-cyclopentyl-2-[4-(quinolin-2-ylmethoxy)phenyl]ethyl]oxaziridine-3-carboxylic acid Traditional Name: 3-[2-cyclopentyl-2-[4-(2-quinolylmethoxy)phenyl]ethyl]oxaziridine-3-carboxylic acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(CC2(NO2)C(=O)O)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC(C1)C(CC2(NO2)C(=O)O)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H26N2O4/c28-24(29)25(27-31-25)15-22(17-5-1-2-6-17)18-10-13-21(14-11-18)30-16-20-12-9-19-7-3-4-8-23(19)26-20/h3-4,7-14,17,22,27H,1-2,5-6,15-16H2,(H,28,29)