1-(1,3-benzodioxol-5-yl)-3-[(4-cyclohexylphenyl)amino]propan-1-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(4-cyclohexylphenyl)amino]propan-1-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(4-cyclohexylanilino)propan-1-one CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(4-cyclohexylanilino)-1-propanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-cyclohexylanilino)propan-1-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(4-cyclohexylanilino)propan-1-one Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)NCCC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)NCCC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H25NO3/c24-20(18-8-11-21-22(14-18)26-15-25-21)12-13-23-19-9-6-17(7-10-19)16-4-2-1-3-5-16/h6-11,14,16,23H,1-5,12-13,15H2