2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]ethanone Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]ethanone CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-[2-(4-methoxyphenyl)-1-pyrrolidinyl]ethanone IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-[2-(4-methoxyphenyl)pyrrolidino]ethanone Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23NO4S/c1-24-16-6-4-15(5-7-16)18-3-2-10-22(18)21(23)14-27-17-8-9-19-20(13-17)26-12-11-25-19/h4-9,13,18H,2-3,10-12,14H2,1H3