1-[4-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethoxy]phenyl]octan-2-one

Systemtic Name: 1-[4-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethoxy]phenyl]octan-2-one Openeye Name: 1-[4-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethoxy]phenyl]octan-2-one CAS Name: 1-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenyl]-2-octanone IUPAC Name: 1-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenyl]octan-2-one Traditional Name: 1-[4-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethoxy]phenyl]octan-2-one Formula: C25H35NO4 MolecularWeight: 413.5497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CC1=CC=C(C=C1)OCCNCC(COC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCC(=O)CC1=CC=C(C=C1)OCCNCC(COC2=CC=CC=C2)O

InChI

InChI=1S/C25H35NO4/c1-2-3-4-6-9-22(27)18-21-12-14-25(15-13-21)29-17-16-26-19-23(28)20-30-24-10-7-5-8-11-24/h5,7-8,10-15,23,26,28H,2-4,6,9,16-20H2,1H3