1-[(3S)-3-[2-cyclopentyl-1,2-bis(oxidanyl)-2-phenyl-ethoxy]pyrrolidin-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[(3S)-3-[2-cyclopentyl-1,2-bis(oxidanyl)-2-phenyl-ethoxy]pyrrolidin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[(3S)-3-(2-cyclopentyl-1,2-dihydroxy-2-phenyl-ethoxy)pyrrolidin-1-yl]-2-phenyl-ethanone CAS Name: 1-[(3S)-3-(2-cyclopentyl-1,2-dihydroxy-2-phenylethoxy)-1-pyrrolidinyl]-2-phenylethanone IUPAC Name: 1-[(3S)-3-(2-cyclopentyl-1,2-dihydroxy-2-phenylethoxy)pyrrolidin-1-yl]-2-phenylethanone Traditional Name: 1-[(3S)-3-(2-cyclopentyl-1,2-dihydroxy-2-phenyl-ethoxy)pyrrolidino]-2-phenyl-ethanone Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(O)OC3CCN(C3)C(=O)CC4=CC=CC=C4)O

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)(C(O)O[C@H]3CCN(C3)C(=O)CC4=CC=CC=C4)O

InChI

InChI=1S/C25H31NO4/c27-23(17-19-9-3-1-4-10-19)26-16-15-22(18-26)30-24(28)25(29,21-13-7-8-14-21)20-11-5-2-6-12-20/h1-6,9-12,21-22,24,28-29H,7-8,13-18H2/t22-,24?,25?/m0/s1