[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone CAS Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-(2-methyl-5-methylsulfonylphenyl)methanone IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(2-methyl-5-methylsulfonylphenyl)methanone Traditional Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-(5-mesyl-2-methyl-phenyl)methanone Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23NO5S/c1-14-5-7-16(28(2,24)25)13-17(14)21(23)22-9-3-4-18(22)15-6-8-19-20(12-15)27-11-10-26-19/h5-8,12-13,18H,3-4,9-11H2,1-2H3