5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]carbonyl-N,N-diethyl-2-methoxy-benzenesulfonamide

Systemtic Name: 5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]carbonyl-N,N-diethyl-2-methoxy-benzenesulfonamide Openeye Name: 5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]-N,N-diethyl-2-methoxy-benzenesulfonamide CAS Name: 5-[[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-oxomethyl]-N,N-diethyl-2-methoxybenzenesulfonamide IUPAC Name: 5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]-N,N-diethyl-2-methoxybenzenesulfonamide Traditional Name: 5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]-N,N-diethyl-2-methoxy-benzenesulfonamide Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCC[C@H]2C3=CC4=C(C=C3)OCCCO4)OC

InChI

InChI=1S/C25H32N2O6S/c1-4-26(5-2)34(29,30)24-17-19(10-12-22(24)31-3)25(28)27-13-6-8-20(27)18-9-11-21-23(16-18)33-15-7-14-32-21/h9-12,16-17,20H,4-8,13-15H2,1-3H3/t20-/m0/s1