3-(4-butylphenyl)-2-(2-oxidanyl-3-piperidin-1-yl-propoxy)-1-phenyl-propan-1-one

Systemtic Name: 3-(4-butylphenyl)-2-(2-oxidanyl-3-piperidin-1-yl-propoxy)-1-phenyl-propan-1-one Openeye Name: 3-(4-butylphenyl)-2-[2-hydroxy-3-(1-piperidyl)propoxy]-1-phenyl-propan-1-one CAS Name: 3-(4-butylphenyl)-2-[2-hydroxy-3-(1-piperidinyl)propoxy]-1-phenyl-1-propanone IUPAC Name: 3-(4-butylphenyl)-2-(2-hydroxy-3-piperidin-1-ylpropoxy)-1-phenylpropan-1-one Traditional Name: 3-(4-butylphenyl)-2-(2-hydroxy-3-piperidino-propoxy)-1-phenyl-propan-1-one Formula: C27H37NO3 MolecularWeight: 423.58758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(C(=O)C2=CC=CC=C2)OCC(CN3CCCCC3)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(C(=O)C2=CC=CC=C2)OCC(CN3CCCCC3)O

InChI

InChI=1S/C27H37NO3/c1-2-3-10-22-13-15-23(16-14-22)19-26(27(30)24-11-6-4-7-12-24)31-21-25(29)20-28-17-8-5-9-18-28/h4,6-7,11-16,25-26,29H,2-3,5,8-10,17-21H2,1H3