[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]phenyl]-pyrrolidino-methanone Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H21NO3S/c22-20(21-9-1-2-10-21)16-5-3-15(4-6-16)14-25-17-7-8-18-19(13-17)24-12-11-23-18/h3-8,13H,1-2,9-12,14H2