3-acridin-9-yl-1-[(2S,4R)-2-(hydroxymethyl)-4-oxidanyl-pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-acridin-9-yl-1-[(2S,4R)-2-(hydroxymethyl)-4-oxidanyl-pyrrolidin-1-yl]propan-1-one Openeye Name: 3-acridin-9-yl-1-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(9-acridinyl)-1-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-acridin-9-yl-1-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-acridin-9-yl-1-[(2S,4R)-4-hydroxy-2-methylol-pyrrolidino]propan-1-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CO)C(=O)CCC2=C3C=CC=CC3=NC4=CC=CC=C42)O

Isomeric SMILES

C1[C@H](CN([C@@H]1CO)C(=O)CCC2=C3C=CC=CC3=NC4=CC=CC=C42)O

InChI

InChI=1S/C21H22N2O3/c24-13-14-11-15(25)12-23(14)21(26)10-9-16-17-5-1-3-7-19(17)22-20-8-4-2-6-18(16)20/h1-8,14-15,24-25H,9-13H2/t14-,15+/m0/s1