1-[4-[3-[2-(4-methoxyphenyl)azepan-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[4-[3-[2-(4-methoxyphenyl)azepan-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[4-[2-hydroxy-3-[2-(4-methoxyphenyl)azepan-1-yl]propoxy]phenyl]ethanone CAS Name: 1-[4-[2-hydroxy-3-[2-(4-methoxyphenyl)-1-azepanyl]propoxy]phenyl]ethanone IUPAC Name: 1-[4-[2-hydroxy-3-[2-(4-methoxyphenyl)azepan-1-yl]propoxy]phenyl]ethanone Traditional Name: 1-[4-[2-hydroxy-3-[2-(4-methoxyphenyl)azepan-1-yl]propoxy]phenyl]ethanone Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(CN2CCCCCC2C3=CC=C(C=C3)OC)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(CN2CCCCCC2C3=CC=C(C=C3)OC)O

InChI

InChI=1S/C24H31NO4/c1-18(26)19-7-13-23(14-8-19)29-17-21(27)16-25-15-5-3-4-6-24(25)20-9-11-22(28-2)12-10-20/h7-14,21,24,27H,3-6,15-17H2,1-2H3