[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-propan-2-ylsulfonylphenyl)methanone

Systemtic Name: [2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-propan-2-ylsulfonylphenyl)methanone Openeye Name: [2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-isopropylsulfonylphenyl)methanone CAS Name: [2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-(4-propan-2-ylsulfonylphenyl)methanone IUPAC Name: [2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-propan-2-ylsulfonylphenyl)methanone Traditional Name: [2-(3,4-dimethoxyphenyl)pyrrolidino]-(4-isopropylsulfonylphenyl)methanone Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCCC2C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCCC2C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H27NO5S/c1-15(2)29(25,26)18-10-7-16(8-11-18)22(24)23-13-5-6-19(23)17-9-12-20(27-3)21(14-17)28-4/h7-12,14-15,19H,5-6,13H2,1-4H3