N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-4-methoxy-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-4-methoxy-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-4-methoxy-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@@H](C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3

InChI

InChI=1S/C22H28N2O4S/c1-15-7-8-16(2)19(13-15)17(3)23-29(26,27)18-9-10-21(28-4)20(14-18)22(25)24-11-5-6-12-24/h7-10,13-14,17,23H,5-6,11-12H2,1-4H3/t17-/m1/s1