2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3-pyrrolidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-[3-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C23H27N3O6S MolecularWeight: 473.54198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC(=C1)C(=O)N2CCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC(=O)NC1=CC=CC(=C1)C(=O)N2CCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H27N3O6S/c1-25(33(29,30)19-8-9-20-21(15-19)32-13-5-12-31-20)16-22(27)24-18-7-4-6-17(14-18)23(28)26-10-2-3-11-26/h4,6-9,14-15H,2-3,5,10-13,16H2,1H3,(H,24,27)