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

Systemtic Name: 5-acridin-9-yl-1-[(2S,4R)-2-(hydroxymethyl)-4-oxidanyl-pyrrolidin-1-yl]pentan-1-one Openeye Name: 5-acridin-9-yl-1-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]pentan-1-one CAS Name: 5-(9-acridinyl)-1-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)-1-pyrrolidinyl]-1-pentanone IUPAC Name: 5-acridin-9-yl-1-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]pentan-1-one Traditional Name: 5-acridin-9-yl-1-[(2S,4R)-4-hydroxy-2-methylol-pyrrolidino]pentan-1-one Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CO)C(=O)CCCCC2=C3C=CC=CC3=NC4=CC=CC=C42)O

Isomeric SMILES

C1[C@H](CN([C@@H]1CO)C(=O)CCCCC2=C3C=CC=CC3=NC4=CC=CC=C42)O

InChI

InChI=1S/C23H26N2O3/c26-15-16-13-17(27)14-25(16)23(28)12-6-3-7-18-19-8-1-4-10-21(19)24-22-11-5-2-9-20(18)22/h1-2,4-5,8-11,16-17,26-27H,3,6-7,12-15H2/t16-,17+/m0/s1