N,N-diethyl-4-[3-(4-methoxyphenyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[3-(4-methoxyphenyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-(4-methoxyphenyl)pyrrolidine-1-carbonyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[[3-(4-methoxyphenyl)-1-pyrrolidinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-(4-methoxyphenyl)pyrrolidine-1-carbonyl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-(4-methoxyphenyl)pyrrolidine-1-carbonyl]benzenesulfonamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O4S/c1-4-24(5-2)29(26,27)21-12-8-18(9-13-21)22(25)23-15-14-19(16-23)17-6-10-20(28-3)11-7-17/h6-13,19H,4-5,14-16H2,1-3H3