[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]-(4-methylsulfanylphenyl)methanone

Systemtic Name: [1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Openeye Name: [1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidyl]-(4-methylsulfanylphenyl)methanone CAS Name: [1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidinyl]-[4-(methylthio)phenyl]methanone IUPAC Name: [1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Traditional Name: [1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidyl]-[4-(methylthio)phenyl]methanone Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)C2CCCN(C2)CC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)C2CCCN(C2)CC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25NO3S/c1-27-19-7-5-17(6-8-19)22(24)18-3-2-10-23(15-18)14-16-4-9-20-21(13-16)26-12-11-25-20/h4-9,13,18H,2-3,10-12,14-15H2,1H3