3-(4-chlorophenyl)sulfanyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]propan-1-one Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]propan-1-one CAS Name: 3-[(4-chlorophenyl)thio]-1-[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]propan-1-one Traditional Name: 3-[(4-chlorophenyl)thio]-1-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]propan-1-one Formula: C23H24ClNO4S MolecularWeight: 445.95896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C(=O)CCSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C(=O)CCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H24ClNO4S/c24-18-2-4-19(5-3-18)30-14-9-22(26)25-10-7-16(8-11-25)23(27)17-1-6-20-21(15-17)29-13-12-28-20/h1-6,15-16H,7-14H2