3-(4-butylphenyl)-2-[2-oxidanyl-2-(propylamino)propoxy]-1-phenyl-propan-1-one

Systemtic Name: 3-(4-butylphenyl)-2-[2-oxidanyl-2-(propylamino)propoxy]-1-phenyl-propan-1-one Openeye Name: 3-(4-butylphenyl)-2-[2-hydroxy-2-(propylamino)propoxy]-1-phenyl-propan-1-one CAS Name: 3-(4-butylphenyl)-2-[2-hydroxy-2-(propylamino)propoxy]-1-phenyl-1-propanone IUPAC Name: 3-(4-butylphenyl)-2-[2-hydroxy-2-(propylamino)propoxy]-1-phenylpropan-1-one Traditional Name: 3-(4-butylphenyl)-2-[2-hydroxy-2-(propylamino)propoxy]-1-phenyl-propan-1-one Formula: C25H35NO3 MolecularWeight: 397.5503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO3/c1-4-6-10-20-13-15-21(16-14-20)18-23(24(27)22-11-8-7-9-12-22)29-19-25(3,28)26-17-5-2/h7-9,11-16,23,26,28H,4-6,10,17-19H2,1-3H3