4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[1-(2-methylpropanoyl)piperidin-4-yl]butanamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[1-(2-methylpropanoyl)piperidin-4-yl]butanamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[1-(2-methylpropanoyl)-4-piperidyl]butanamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]butanamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[1-(2-methylpropanoyl)piperidin-4-yl]butanamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(1-isobutyryl-4-piperidyl)butyramide Formula: C22H33N3O6S MolecularWeight: 467.57892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)NC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)NC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C22H33N3O6S/c1-16(2)22(27)25-11-8-17(9-12-25)24-21(26)5-3-10-23-32(28,29)18-6-7-19-20(15-18)31-14-4-13-30-19/h6-7,15-17,23H,3-5,8-14H2,1-2H3,(H,24,26)