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

Systemtic Name: 1-[4-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethoxy]phenyl]hexan-2-one Openeye Name: 1-[4-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethoxy]phenyl]hexan-2-one CAS Name: 1-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenyl]-2-hexanone IUPAC Name: 1-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenyl]hexan-2-one Traditional Name: 1-[4-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethoxy]phenyl]hexan-2-one Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO4/c1-2-3-7-20(25)16-19-10-12-23(13-11-19)27-15-14-24-17-21(26)18-28-22-8-5-4-6-9-22/h4-6,8-13,21,24,26H,2-3,7,14-18H2,1H3