3-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methoxy-benzamide Formula: C23H28N2O6S MolecularWeight: 460.54322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H28N2O6S/c1-29-20-9-7-17(15-22(20)32(27,28)25-11-4-2-3-5-12-25)23(26)24-18-8-10-19-21(16-18)31-14-6-13-30-19/h7-10,15-16H,2-6,11-14H2,1H3,(H,24,26)