ethanol; N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-sulfinyl-ethanamide

Systemtic Name: ethanol; N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-sulfinyl-ethanamide Openeye Name: ethanol; N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-2-sulfinyl-acetamide CAS Name: ethanol; N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-2-sulfinylacetamide IUPAC Name: ethanol; N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-sulfinylacetamide Traditional Name: ethanol; N-[3-[3-(piperidinomethyl)phenoxy]propyl]-2-sulfinyl-acetamide Formula: C19H30N2O4S MolecularWeight: 382.5175

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Descriptors Computed from Structure

Canonical SMILES:

CCO.C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)C=S=O

Isomeric SMILES

CCO.C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)C=S=O

InChI

InChI=1S/C17H24N2O3S.C2H6O/c20-17(14-23-21)18-8-5-11-22-16-7-4-6-15(12-16)13-19-9-2-1-3-10-19;1-2-3/h4,6-7,12,14H,1-3,5,8-11,13H2,(H,18,20);3H,2H2,1H3