2-(hydroxymethyl)-4-[1-oxidanyl-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol; 9-oxidanylidenefluorene-1-carboxylic acid

Systemtic Name: 2-(hydroxymethyl)-4-[1-oxidanyl-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol; 9-oxidanylidenefluorene-1-carboxylic acid Openeye Name: 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol; 9-oxofluorene-1-carboxylic acid CAS Name: 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol; 9-oxo-1-fluorenecarboxylic acid IUPAC Name: 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol; 9-oxofluorene-1-carboxylic acid Traditional Name: 4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]-2-methylol-phenol; 9-ketofluorene-1-carboxylic acid Formula: C39H45NO7 MolecularWeight: 639.7771

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O.C1=CC=C2C(=C1)C3=C(C2=O)C(=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O.C1=CC=C2C(=C1)C3=C(C2=O)C(=CC=C3)C(=O)O

InChI

InChI=1S/C25H37NO4.C14H8O3/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21;15-13-10-5-2-1-4-8(10)9-6-3-7-11(12(9)13)14(16)17/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2;1-7H,(H,16,17)