1-[5-oxidanyl-2-(8-oxidanyldibenzofuran-1-yl)-2-phenethyl-pyrrolidin-1-yl]pentan-1-one

Systemtic Name: 1-[5-oxidanyl-2-(8-oxidanyldibenzofuran-1-yl)-2-phenethyl-pyrrolidin-1-yl]pentan-1-one Openeye Name: 1-[5-hydroxy-2-(8-hydroxydibenzofuran-1-yl)-2-phenethyl-pyrrolidin-1-yl]pentan-1-one CAS Name: 1-[5-hydroxy-2-(8-hydroxy-1-dibenzofuranyl)-2-phenethyl-1-pyrrolidinyl]-1-pentanone IUPAC Name: 1-[5-hydroxy-2-(8-hydroxydibenzofuran-1-yl)-2-phenethylpyrrolidin-1-yl]pentan-1-one Traditional Name: 1-[5-hydroxy-2-(8-hydroxydibenzofuran-1-yl)-2-phenethyl-pyrrolidino]pentan-1-one Formula: C29H31NO4 MolecularWeight: 457.56074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C(CCC1(CCC2=CC=CC=C2)C3=C4C(=CC=C3)OC5=C4C=C(C=C5)O)O

Isomeric SMILES

CCCCC(=O)N1C(CCC1(CCC2=CC=CC=C2)C3=C4C(=CC=C3)OC5=C4C=C(C=C5)O)O

InChI

InChI=1S/C29H31NO4/c1-2-3-12-26(32)30-27(33)16-18-29(30,17-15-20-8-5-4-6-9-20)23-10-7-11-25-28(23)22-19-21(31)13-14-24(22)34-25/h4-11,13-14,19,27,31,33H,2-3,12,15-18H2,1H3