4-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 4-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3-keto-propyl]benzenesulfonamide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC(N(C1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H26N2O5S/c23-30(26,27)18-8-4-16(5-9-18)6-11-22(25)24-12-1-3-19(24)17-7-10-20-21(15-17)29-14-2-13-28-20/h4-5,7-10,15,19H,1-3,6,11-14H2,(H2,23,26,27)