N-(2-diethylaminoethyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Openeye Name: N-(2-diethylaminoethyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide CAS Name: N-(2-diethylaminoethyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide IUPAC Name: N-(2-diethylaminoethyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Traditional Name: N-(2-diethylaminoethyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C22H29N3O5S/c1-3-25(4-2)13-12-23-22(26)17-6-8-18(9-7-17)24-31(27,28)19-10-11-20-21(16-19)30-15-5-14-29-20/h6-11,16,24H,3-5,12-15H2,1-2H3,(H,23,26)